N-(3-{[4-anilino-1-(3,4-dimethylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-2,4-dichlorobenzamide
Chemical Structure Depiction of
N-(3-{[4-anilino-1-(3,4-dimethylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-2,4-dichlorobenzamide
N-(3-{[4-anilino-1-(3,4-dimethylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-2,4-dichlorobenzamide
Compound characteristics
| Compound ID: | V031-2716 |
| Compound Name: | N-(3-{[4-anilino-1-(3,4-dimethylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-2,4-dichlorobenzamide |
| Molecular Weight: | 588.51 |
| Molecular Formula: | C31 H23 Cl2 N3 O3 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1C)N1C(C(=C(C1=O)Sc1cccc(c1)NC(c1ccc(cc1[Cl])[Cl])=O)Nc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.2551 |
| logD: | 7.2479 |
| logSw: | -6.4784 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.083 |
| InChI Key: | WOTJHAKOVGLZOB-UHFFFAOYSA-N |