N-(4-{[1-(3-methoxypropyl)-4-(4-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzenesulfonamide
Chemical Structure Depiction of
N-(4-{[1-(3-methoxypropyl)-4-(4-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzenesulfonamide
N-(4-{[1-(3-methoxypropyl)-4-(4-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzenesulfonamide
Compound characteristics
| Compound ID: | V028-3406 |
| Compound Name: | N-(4-{[1-(3-methoxypropyl)-4-(4-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzenesulfonamide |
| Molecular Weight: | 537.66 |
| Molecular Formula: | C27 H27 N3 O5 S2 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)NC1=C(C(N(CCCOC)C1=O)=O)Sc1ccc(cc1)NS(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4923 |
| logD: | 4.4539 |
| logSw: | -4.126 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.845 |
| InChI Key: | BYCDDZHZGPUANZ-UHFFFAOYSA-N |