4-chloro-N-(4-{[4-(4-methylanilino)-2,5-dioxo-1-(propan-2-yl)-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
Chemical Structure Depiction of
4-chloro-N-(4-{[4-(4-methylanilino)-2,5-dioxo-1-(propan-2-yl)-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
4-chloro-N-(4-{[4-(4-methylanilino)-2,5-dioxo-1-(propan-2-yl)-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
Compound characteristics
| Compound ID: | V030-6894 |
| Compound Name: | 4-chloro-N-(4-{[4-(4-methylanilino)-2,5-dioxo-1-(propan-2-yl)-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide |
| Molecular Weight: | 506.02 |
| Molecular Formula: | C27 H24 Cl N3 O3 S |
| Salt: | not_available |
| Smiles: | CC(C)N1C(C(=C(C1=O)Sc1ccc(cc1)NC(c1ccc(cc1)[Cl])=O)Nc1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7951 |
| logD: | 5.7936 |
| logSw: | -6.113 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.686 |
| InChI Key: | NNOSDKVCLFNMEH-UHFFFAOYSA-N |