4-chloro-N-(3-{[4-(2-methoxy-5-methylanilino)-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
Chemical Structure Depiction of
4-chloro-N-(3-{[4-(2-methoxy-5-methylanilino)-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
4-chloro-N-(3-{[4-(2-methoxy-5-methylanilino)-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
Compound characteristics
| Compound ID: | V025-1550 |
| Compound Name: | 4-chloro-N-(3-{[4-(2-methoxy-5-methylanilino)-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide |
| Molecular Weight: | 566.08 |
| Molecular Formula: | C29 H28 Cl N3 O5 S |
| Smiles: | Cc1ccc(c(c1)NC1=C(C(N(CCCOC)C1=O)=O)Sc1cccc(c1)NC(c1ccc(cc1)[Cl])=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.9546 |
| logD: | 4.9374 |
| logSw: | -5.0579 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.219 |
| InChI Key: | PKYLJQBJIGSLMY-UHFFFAOYSA-N |