N-[3-({1-[(furan-2-yl)methyl]-4-(4-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-[3-({1-[(furan-2-yl)methyl]-4-(4-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-2H-1,3-benzodioxole-5-carboxamide
N-[3-({1-[(furan-2-yl)methyl]-4-(4-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V027-9665 |
| Compound Name: | N-[3-({1-[(furan-2-yl)methyl]-4-(4-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 553.59 |
| Molecular Formula: | C30 H23 N3 O6 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)NC1=C(C(N(Cc2ccco2)C1=O)=O)Sc1cccc(c1)NC(c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2066 |
| logD: | 5.2062 |
| logSw: | -4.9848 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.558 |
| InChI Key: | LOLVZTTVADNACG-UHFFFAOYSA-N |