3-chloro-N-(4-{[1-(2,4-dimethoxyphenyl)-4-(4-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
Chemical Structure Depiction of
3-chloro-N-(4-{[1-(2,4-dimethoxyphenyl)-4-(4-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
3-chloro-N-(4-{[1-(2,4-dimethoxyphenyl)-4-(4-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
Compound characteristics
| Compound ID: | V031-2688 |
| Compound Name: | 3-chloro-N-(4-{[1-(2,4-dimethoxyphenyl)-4-(4-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide |
| Molecular Weight: | 600.09 |
| Molecular Formula: | C32 H26 Cl N3 O5 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)NC1=C(C(N(C1=O)c1ccc(cc1OC)OC)=O)Sc1ccc(cc1)NC(c1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.4706 |
| logD: | 6.4694 |
| logSw: | -6.3245 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.956 |
| InChI Key: | PCNYFQATMFFZRD-UHFFFAOYSA-N |