2-chloro-N-(3-{[4-(4-methoxyanilino)-1-(4-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
Chemical Structure Depiction of
2-chloro-N-(3-{[4-(4-methoxyanilino)-1-(4-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
2-chloro-N-(3-{[4-(4-methoxyanilino)-1-(4-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
Compound characteristics
| Compound ID: | V029-7872 |
| Compound Name: | 2-chloro-N-(3-{[4-(4-methoxyanilino)-1-(4-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide |
| Molecular Weight: | 586.07 |
| Molecular Formula: | C31 H24 Cl N3 O5 S |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)NC1=C(C(N(C1=O)c1ccc(cc1)OC)=O)Sc1cccc(c1)NC(c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.5587 |
| logD: | 5.5579 |
| logSw: | -5.8449 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.17 |
| InChI Key: | VPRUVGMSPBHFKZ-UHFFFAOYSA-N |