N-[3-({1-[(furan-2-yl)methyl]-4-(2-methoxy-5-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-3-methylbutanamide
Chemical Structure Depiction of
N-[3-({1-[(furan-2-yl)methyl]-4-(2-methoxy-5-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-3-methylbutanamide
N-[3-({1-[(furan-2-yl)methyl]-4-(2-methoxy-5-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-3-methylbutanamide
Compound characteristics
| Compound ID: | V029-8280 |
| Compound Name: | N-[3-({1-[(furan-2-yl)methyl]-4-(2-methoxy-5-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-3-methylbutanamide |
| Molecular Weight: | 519.62 |
| Molecular Formula: | C28 H29 N3 O5 S |
| Salt: | not_available |
| Smiles: | CC(C)CC(Nc1cccc(c1)SC1=C(C(N(Cc2ccco2)C1=O)=O)Nc1cc(C)ccc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8193 |
| logD: | 4.8146 |
| logSw: | -4.5324 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.434 |
| InChI Key: | QAHYMWDAZNEASW-UHFFFAOYSA-N |