AC1LP6PR
4-[(3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanylmethyl]benzoic acid
Also Known As: Oprea1_259247|AM-807/14956039|4-[(3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanylmethyl]benzoic acid|4-{[(3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]methyl}benzoic acid|4-(((3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio)methyl)benzoic acid|4-[({3-CYANO-4-PHENYL-5H,6H,7H-CYCLOPENTA[B]PYRIDIN-2-YL}SULFANYL)METHYL]BENZOIC ACID
| Molecular Formula | C23H18N2O2S |
|---|---|
| Molecular Weight | 386.1089 g/mol |
| LogP | 5.09948 |
| Topological Polar Surface Area | 73.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 386.1089 |
| Monoisotopic Mass | 386.1089 |
| Heavy Atoms | 28 |
| Complexity | 1070.4967 |
Chemical Identifiers
| CAS Number | 354556-38-0 |
|---|---|
| SMILES | C1CC2=C(C1)N=C(C(=C2C3=CC=CC=C3)C#N)SCC4=CC=C(C=C4)C(=O)O |
Product Overview
AC1LP6PR (CAS 354556-38-0), with molecular formula C23H18N2O2S and molecular weight 386.1089 g/mol. IUPAC: 4-[(3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanylmethyl]benzoic acid.
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