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324579-95-5 | N-(4-Cyclopropyl-thiazol-2-yl)-succinamic acid
CAS No: 324579-95-5 Catalog No: AG01F30B MDL No:
Product Description
Catalog Number:
AG01F30B
Chemical Name:
N-(4-Cyclopropyl-thiazol-2-yl)-succinamic acid
CAS Number:
324579-95-5
Molecular Formula:
C10H12N2O3S
Molecular Weight:
240.2789
IUPAC Name:
4-[(4-cyclopropyl-1,3-thiazol-2-yl)amino]-4-oxobutanoic acid
InChI:
InChI=1S/C10H12N2O3S/c13-8(3-4-9(14)15)12-10-11-7(5-16-10)6-1-2-6/h5-6H,1-4H2,(H,14,15)(H,11,12,13)
InChI Key:
VPHZHJHSHBGPSH-UHFFFAOYSA-N
SMILES:
O=C(Nc1scc(n1)C1CC1)CCC(=O)O
Properties
Complexity:
294
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.057g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
240.277g/mol
Monoisotopic Mass:
240.057g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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