N-(4-{[1-(3,4-dimethylphenyl)-4-(2-methoxy-5-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)thiophene-2-carboxamide
Chemical Structure Depiction of
N-(4-{[1-(3,4-dimethylphenyl)-4-(2-methoxy-5-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)thiophene-2-carboxamide
N-(4-{[1-(3,4-dimethylphenyl)-4-(2-methoxy-5-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)thiophene-2-carboxamide
Compound characteristics
| Compound ID: | V029-3300 |
| Compound Name: | N-(4-{[1-(3,4-dimethylphenyl)-4-(2-methoxy-5-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)thiophene-2-carboxamide |
| Molecular Weight: | 569.7 |
| Molecular Formula: | C31 H27 N3 O4 S2 |
| Salt: | not_available |
| Smiles: | Cc1ccc(c(c1)NC1=C(C(N(C1=O)c1ccc(C)c(C)c1)=O)Sc1ccc(cc1)NC(c1cccs1)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 6.4534 |
| logD: | 6.4534 |
| logSw: | -5.5551 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.034 |
| InChI Key: | YOWGCPCWMVVSSM-UHFFFAOYSA-N |