Products for Research Use Only
RegisterLogin

D-Cl-amidine

CAT: 0013-GTR19206110-02Size: 50 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19206110-02Size:50 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
D-Cl-amidine is a potent and selective inhibitor of peptidyl arginine deiminase 1 (PAD1) . It is a valuable research tool for studying PAD1 function in vitro and in vivo, with applications in investigating autoimmune disorders and cancer biology.
CAS Number
1404060-15-6
Field of Research
Cell Biology, Epigenetics & Chromatin
Smiles
C (N[C@H] (CCCNC (CCl) =N) C (N) =O) (=O) C1=CC=CC=C1
Molecular Formula
C14H19ClN4O2
Molecular Weight
310.78
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

D-Cl-amidine
CAS Number1404060-15-6
PubChem CID71455787
IUPAC NameN-[(2R)-1-amino-5-[(1-amino-2-chloroethylidene)amino]-1-oxopentan-2-yl]benzamide
Molecular FormulaC14H19ClN4O2
Molecular Weight310.78
XLogP0.5
Topological Polar Surface Area111
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count8
Heavy Atom Count21
Formal Charge0
Complexity381
SMILES
C1=CC=C(C=C1)C(=O)N[C@H](CCCN=C(CCl)N)C(=O)N
InChI
InChI=1S/C14H19ClN4O2/c15-9-12(16)18-8-4-7-11(13(17)20)19-14(21)10-5-2-1-3-6-10/h1-3,5-6,11H,4,7-9H2,(H2,16,18)(H2,17,20)(H,19,21)/t11-/m1/s1
InChIKey
BPWATVWOHQZVRP-LLVKDONJSA-N
Chemical Structure
2D Structure
2D structure of D-Cl-amidine
CAS: 1404060-15-6
CID: 71455787
Formula: C14H19ClN4O2
MW: 310.78
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight310.78
XLogP30.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count8
Exact Mass310.1196536
Monoisotopic Mass310.1196536
Topological Polar Surface Area111 Ų
Heavy Atom Count21
Formal Charge0
Complexity381
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
GTR19206205-01Cl-amidine
GTR19176872-01Cl-amidine hydrochloride
GTR19153975-01BB-Cl-Amidine
GTR19156207-01Cl-amidine hydrochloride
GTR19216031-01Cl-amidine TFA
GTR19258203-01BB-Cl-Amidine TFA
GTR19200313-01F-amidine
GTR19029132[D-p-Cl-Phe6, Leu17]-VIP
GTR19029131-01[D-p-Cl-Phe6, Leu17]-VIP acetate
GTR19062197-01[D-p-Cl-Phe6, Leu17]-VIP TFA

Alternative Products

CatalogName
T10932-01D-Cl-amidine
T61155D-Cl-amidine hydrochloride
HY-100574D-01D-Cl-amidine (hydrochloride)
MBS132938Cl-Amidine
HY-100574DRD-Cl-amidine (hydrochloride) (Standard)
HY-100574BCl-amidine (TFA)
HY-W297348-01(Rac) -Cl-amidine
MBS3846249-01Cl-amidine hydrochloride
A12256-50Cl-amidine 50mg
A12256-5Cl-amidine 5mg

Popular Products