3,4,5-trimethoxy-N-[3-({1-(3-methoxypropyl)-2,5-dioxo-4-[4-(propan-2-yl)anilino]-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzamide
Chemical Structure Depiction of
3,4,5-trimethoxy-N-[3-({1-(3-methoxypropyl)-2,5-dioxo-4-[4-(propan-2-yl)anilino]-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzamide
3,4,5-trimethoxy-N-[3-({1-(3-methoxypropyl)-2,5-dioxo-4-[4-(propan-2-yl)anilino]-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzamide
Compound characteristics
| Compound ID: | V028-7150 |
| Compound Name: | 3,4,5-trimethoxy-N-[3-({1-(3-methoxypropyl)-2,5-dioxo-4-[4-(propan-2-yl)anilino]-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzamide |
| Molecular Weight: | 619.74 |
| Molecular Formula: | C33 H37 N3 O7 S |
| Salt: | not_available |
| Smiles: | CC(C)c1ccc(cc1)NC1=C(C(N(CCCOC)C1=O)=O)Sc1cccc(c1)NC(c1cc(c(c(c1)OC)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3185 |
| logD: | 5.3172 |
| logSw: | -5.1884 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.264 |
| InChI Key: | LUIYSZCPNGQNDT-UHFFFAOYSA-N |