N-(3-methoxyphenyl)-N'-[3-({1-(2-methylpropyl)-2,5-dioxo-4-[4-(propan-2-yl)anilino]-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]urea
Chemical Structure Depiction of
N-(3-methoxyphenyl)-N'-[3-({1-(2-methylpropyl)-2,5-dioxo-4-[4-(propan-2-yl)anilino]-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]urea
N-(3-methoxyphenyl)-N'-[3-({1-(2-methylpropyl)-2,5-dioxo-4-[4-(propan-2-yl)anilino]-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]urea
Compound characteristics
| Compound ID: | V028-3448 |
| Compound Name: | N-(3-methoxyphenyl)-N'-[3-({1-(2-methylpropyl)-2,5-dioxo-4-[4-(propan-2-yl)anilino]-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]urea |
| Molecular Weight: | 558.7 |
| Molecular Formula: | C31 H34 N4 O4 S |
| Salt: | not_available |
| Smiles: | CC(C)CN1C(C(=C(C1=O)Sc1cccc(c1)NC(Nc1cccc(c1)OC)=O)Nc1ccc(cc1)C(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 7.3018 |
| logD: | 7.3005 |
| logSw: | -5.6216 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.721 |
| InChI Key: | FOSWITDUZUBLDJ-UHFFFAOYSA-N |