N-[4-({1-(4-methoxyphenyl)-2,5-dioxo-4-[4-(propan-2-yl)anilino]-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]furan-2-carboxamide
Chemical Structure Depiction of
N-[4-({1-(4-methoxyphenyl)-2,5-dioxo-4-[4-(propan-2-yl)anilino]-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]furan-2-carboxamide
N-[4-({1-(4-methoxyphenyl)-2,5-dioxo-4-[4-(propan-2-yl)anilino]-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | V030-6032 |
| Compound Name: | N-[4-({1-(4-methoxyphenyl)-2,5-dioxo-4-[4-(propan-2-yl)anilino]-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]furan-2-carboxamide |
| Molecular Weight: | 553.64 |
| Molecular Formula: | C31 H27 N3 O5 S |
| Salt: | not_available |
| Smiles: | CC(C)c1ccc(cc1)NC1=C(C(N(C1=O)c1ccc(cc1)OC)=O)Sc1ccc(cc1)NC(c1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8411 |
| logD: | 5.841 |
| logSw: | -5.5802 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.205 |
| InChI Key: | CQACXXITRFMBBQ-UHFFFAOYSA-N |