N-[4-({1-[(furan-2-yl)methyl]-2,5-dioxo-4-[4-(propan-2-yl)anilino]-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-N'-(4-methoxyphenyl)urea
Chemical Structure Depiction of
N-[4-({1-[(furan-2-yl)methyl]-2,5-dioxo-4-[4-(propan-2-yl)anilino]-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-N'-(4-methoxyphenyl)urea
N-[4-({1-[(furan-2-yl)methyl]-2,5-dioxo-4-[4-(propan-2-yl)anilino]-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-N'-(4-methoxyphenyl)urea
Compound characteristics
| Compound ID: | V031-2562 |
| Compound Name: | N-[4-({1-[(furan-2-yl)methyl]-2,5-dioxo-4-[4-(propan-2-yl)anilino]-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-N'-(4-methoxyphenyl)urea |
| Molecular Weight: | 582.68 |
| Molecular Formula: | C32 H30 N4 O5 S |
| Salt: | not_available |
| Smiles: | CC(C)c1ccc(cc1)NC1=C(C(N(Cc2ccco2)C1=O)=O)Sc1ccc(cc1)NC(Nc1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 6.9411 |
| logD: | 6.9407 |
| logSw: | -5.681 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 86.198 |
| InChI Key: | NNFHJYXCGQOSAD-UHFFFAOYSA-N |