AC1LDV9K
methyl 2-[(4-methylbenzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Also Known As: Oprea1_323827|Oprea1_473064|KS-00004AG0|BAS 00675454|AG-690/11663680|SR-01000423004-1|methyl 2-[(4-methylbenzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate|METHYL 2-(4-METHYLBENZAMIDO)-4H,5H,6H-CYCLOPENTA[B]THIOPHENE-3-CARBOXYLATE|methyl 2-[(4-methylphenyl)carbonylamino]-4,5,6-trihydrocyclopenta[2,1-b]thioph ene-3-carboxylate|methyl 2-{[(4-methylphenyl)carbonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
| Molecular Formula | C17H17NO3S |
|---|---|
| Molecular Weight | 315.09293 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 83.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 315.09293 |
| Monoisotopic Mass | 315.09293 |
| Heavy Atoms | 22 |
| Complexity | 434.0 |
Chemical Identifiers
| CAS Number | 304666-20-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)NC2=C(C3=C(S2)CCC3)C(=O)OC |
| InChIKey | PZJBMLYFCSPTSA-UHFFFAOYSA-N |
Product Overview
AC1LDV9K (CAS 304666-20-4), with molecular formula C17H17NO3S and molecular weight 315.09293 g/mol. IUPAC: methyl 2-[(4-methylbenzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate.
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