Products for Research Use Only
RegisterLogin

IWP 4

CAT: 0926-BI162786-02Size: 50 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0926-BI162786-02Size:50 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
686772-17-8
Synonyms
N- (6-Methyl-2-benzothiazolyl) -2-[ (3,4,6,7-tetrahydro-3- (2-methoxyphenyl) -4-oxothieno[3,2-d]pyrimidin-2-yl) thio]-acetamide
Smiles
CC1=CC2=C (C=C1) N=C (S2) NC (=O) CSC3=NC4=C (C (=O) N3C5=CC=CC=C5OC) SCC4
Molecular Formula
C23H20N4O3S3
Molecular Weight
496.63 g/mol
Controlled
No

Chemical Information

2-((3-(2-methoxyphenyl)-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl)thio)-N-(6-methylbenzo[d]thiazol-2-yl)acetamide
CAS Number686772-17-8
PubChem CID2155264
IUPAC Name2-[[3-(2-methoxyphenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide
Molecular FormulaC23H20N4O3S3
Molecular Weight496.6
XLogP4.8
Topological Polar Surface Area163
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count6
Heavy Atom Count33
Formal Charge0
Complexity851
SMILES
CC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=NC4=C(C(=O)N3C5=CC=CC=C5OC)SCC4
InChI
InChI=1S/C23H20N4O3S3/c1-13-7-8-14-18(11-13)33-22(24-14)26-19(28)12-32-23-25-15-9-10-31-20(15)21(29)27(23)16-5-3-4-6-17(16)30-2/h3-8,11H,9-10,12H2,1-2H3,(H,24,26,28)
InChIKey
RHUJMHOIQBDFQR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-((3-(2-methoxyphenyl)-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl)thio)-N-(6-methylbenzo[d]thiazol-2-yl)acetamide
CAS: 686772-17-8
CID: 2155264
Formula: C23H20N4O3S3
MW: 496.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight496.6
XLogP34.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count6
Exact Mass496.06975403
Monoisotopic Mass496.06975403
Topological Polar Surface Area163 Ų
Heavy Atom Count33
Formal Charge0
Complexity851
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
NCB35345-01IWP 12
MCB56160-01IWP-3
ZHD60748-01IWP-O1
JXB85075-014,4,4-Trifluorobutanethioamide
FT774274,4,4-Trifluorovaline
AAA461344,4,4-Trifluorobutanamide
AAA406874,4,4-Trifluorobutanal
HCA98858-014- (4'-Bromophenyl) -4-hydroxypiperidine
FE60063-01Ethyl 4,4,4-Trichloroacetoacetate
IC20325-014- (4-Chlorophenyl) -4-hydroxypiperidine

Alternative Products

CatalogName
303-150Riboclear (RNA Cleanup)
TBS10485-100Tribio InVivoMAb Anti-Mouse TIGIT & PD-L1 Bispecific Antibody
TBS10191-1mgTetrahydrocannabinol (THC) Monoclonal Antibody
TBI3024-25MGAc-Leu-Leu-Nle-CHO (ALLN), Calpain inhibitor
122-101ExgeneTM Forensic SV mini
TBS10483-100Tribio InVivoMAb Anti-Mouse PD-L1 & CD28 Bispecific Antibody
TBS10183-1mgMonoclonal Anti-Thyroid Stimulating Hormone (TSH) Antibody
TBS10340-0.5MGInVivo Mouse IgG1 Isotype Control Antibody
121-220Exfection Plasmid EF (Exdotoxin Free, Midi)
TBS10482-100Tribio InVivoMAb Anti-Mouse PD-L1 & OX40 Bispecific Antibody

Popular Products