N-{3-[(4-anilino-2,5-dioxo-1-phenyl-2,5-dihydro-1H-pyrrol-3-yl)sulfanyl]phenyl}-3,4,5-trimethoxybenzamide
Chemical Structure Depiction of
N-{3-[(4-anilino-2,5-dioxo-1-phenyl-2,5-dihydro-1H-pyrrol-3-yl)sulfanyl]phenyl}-3,4,5-trimethoxybenzamide
N-{3-[(4-anilino-2,5-dioxo-1-phenyl-2,5-dihydro-1H-pyrrol-3-yl)sulfanyl]phenyl}-3,4,5-trimethoxybenzamide
Compound characteristics
| Compound ID: | V025-1595 |
| Compound Name: | N-{3-[(4-anilino-2,5-dioxo-1-phenyl-2,5-dihydro-1H-pyrrol-3-yl)sulfanyl]phenyl}-3,4,5-trimethoxybenzamide |
| Molecular Weight: | 581.65 |
| Molecular Formula: | C32 H27 N3 O6 S |
| Smiles: | COc1cc(cc(c1OC)OC)C(Nc1cccc(c1)SC1=C(C(N(C1=O)c1ccccc1)=O)Nc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6063 |
| logD: | 4.6063 |
| logSw: | -4.4317 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.06 |
| InChI Key: | LCESBKQITSDVHF-UHFFFAOYSA-N |