Home Aminos 4-[2-(2-amino-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamido]benzoic acid

4-[2-(2-amino-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamido]benzoic acid

CAS No.:
101413-78-9
Catalog Number:
AG019JJ8
Molecular Formula:
C12H11N3O4S
Molecular Weight:
293.2984
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG019JJ8
Chemical Name:
4-[2-(2-amino-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamido]benzoic acid
CAS Number:
101413-78-9
Molecular Formula:
C12H11N3O4S
Molecular Weight:
293.2984
MDL Number:
MFCD05267025
IUPAC Name:
4-[[2-(2-amino-4-oxo-1,3-thiazol-5-yl)acetyl]amino]benzoic acid
InChI:
InChI=1S/C12H11N3O4S/c13-12-15-10(17)8(20-12)5-9(16)14-7-3-1-6(2-4-7)11(18)19/h1-4,8H,5H2,(H,14,16)(H,18,19)(H2,13,15,17)
InChI Key:
WMNGKZGRTLSGRP-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccc(cc1)C(=O)O)CC1SC(=NC1=O)N
Properties
Complexity:
458  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.047g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
293.297g/mol
Monoisotopic Mass:
293.047g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
147A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties