Products for Research Use Only
RegisterLogin

Gly-Cyclopropane-Exatecan

CAT: 0804-HY-148696ASize: 1 EachDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0804-HY-148696ASize:1 Each
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
Gly-Cyclopropane-Exatecan involves in the synthesis of anti-B7-H4 ADC, containing Exatecan , a DNA Topoisomerase I inhibitor. Gly-Cyclopropane-Exatecan participated in the formation of the ADC hu2F7-Exatecan (compound 34), which showed antitumor activity in vivo and in vitro[1].
CAS Number
2414254-49-0
UNSPSC
12352005
Target
ADC Payload; Topoisomerase
Type
Reference compound
Related Pathways
Antibody-drug Conjugate/ADC Related; Cell Cycle/DNA Damage
Applications
Cancer-programmed cell death
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/gly-cyclopropane-exatecan.html
Solubility
10 mM in DMSO
Smiles
NCC(NCOC(C1CC1)C(N[C@@H]2C3=C4C(C(N5C4)=CC([C@](O)(C(OC6)=O)CC)=C6C5=O)=NC7=CC(F)=C(C)C(CC2)=C73)=O)=O
Molecular Formula
C32H34FN5O7
Molecular Weight
619.64
References & Citations
[1]Hua Haiqing, et al. Anti-b7-h4 antibody-drug conjugate and medicinal use thereof: World Intellectual Property Organization, WO2020244657. 2020-12-10.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Isoform
Camptothecins

Chemical Information

Gly-Cyclopropane-Exatecan
CAS Number2414254-49-0
PubChem CID155733579
IUPAC Name2-[[(2-aminoacetyl)amino]methoxy]-2-cyclopropyl-N-[(10S,23S)-10-ethyl-18-fluoro-10-hydroxy-19-methyl-5,9-dioxo-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaen-23-yl]acetamide
Molecular FormulaC32H34FN5O7
Molecular Weight619.6
XLogP-0.2
Topological Polar Surface Area173
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count10
Rotatable Bond Count8
Heavy Atom Count45
Formal Charge0
Complexity1350
SMILES
CC[C@@]1(C2=C(COC1=O)C(=O)N3CC4=C5[C@H](CCC6=C5C(=CC(=C6C)F)N=C4C3=C2)NC(=O)C(C7CC7)OCNC(=O)CN)O
InChI
InChI=1S/C32H34FN5O7/c1-3-32(43)19-8-23-27-17(11-38(23)30(41)18(19)12-44-31(32)42)26-21(7-6-16-14(2)20(33)9-22(36-27)25(16)26)37-29(40)28(15-4-5-15)45-13-35-24(39)10-34/h8-9,15,21,28,43H,3-7,10-13,34H2,1-2H3,(H,35,39)(H,37,40)/t21-,28?,32-/m0/s1
InChIKey
CEFSJFYTDCGHFB-XXCFHSPASA-N
Chemical Structure
2D Structure
2D structure of Gly-Cyclopropane-Exatecan
CAS: 2414254-49-0
CID: 155733579
Formula: C32H34FN5O7
MW: 619.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight619.6
XLogP3-0.2
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count10
Rotatable Bond Count8
Exact Mass619.24422660
Monoisotopic Mass619.24422660
Topological Polar Surface Area173 Ų
Heavy Atom Count45
Formal Charge0
Complexity1350
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
HY-148696BGly- (S) -Cyclopropane-Exatecan
HY-148668A-01MC-Gly-Gly-Phe-Gly- (S) -Cyclopropane-Exatecan
HY-148668-01MC-Gly-Gly-Phe-Gly- (R) -Cyclopropane-Exatecan
HY-150402-01MC-Gly-Gly-Phe-Gly-amide-cyclopropanol-amide-Exatecan
HY-147307-01MC-Gly-Gly-Phe-Gly-Cyclobutanecarboxylic-Exatecan
HY-153067Mal-cyclohexane-Gly-Gly-Phe-Gly-Exatecan
HY-153795-01Mal-PEG2-Gly-Gly-Phe-Gly-Exatecan
HY-160649-01MC-Gly-Gly-Phe-Gly-GABA-Exatecan
HY-148812Gly-Mal-Gly-Gly-Phe-Gly-amide-methylcyclopropane-Exatecan
HY-13631M-01Gly-Gly-Phe-Gly-NH-O-CO-Exatecan

Alternative Products

CatalogName
T74735-01Gly-Cyclopropane-Exatecan
TYD-02798-01Gly- (S) -Cyclopropane-Exatecan
T74724-01MC-Gly-Gly-Phe-Gly- (S) -Cyclopropane-Exatecan
T74723-01MC-Gly-Gly-Phe-Gly- (R) -Cyclopropane-Exatecan
MBS5816661MC-Gly-Gly-Phe-Gly-(R)-Cyclopropane-Exatecan
MBS5816662MC-Gly-Gly-Phe-Gly-(S)-Cyclopropane-Exatecan
BA2707-5MC-Gly-Gly-Phe-Gly-GABA-Exatecan
BA2667-5Mal-PEG2-Gly-Gly-Phe-Gly-Exatecan
MBS5819529MC-Gly-Gly-Phe-Gly-Cyclobutanecarboxylic-Exatecan
MBS5823525Mal-cyclohexane-Gly-Gly-Phe-Gly-Exatecan

Popular Products