5-(diethylamino)-2-{[(2-methylpropyl)(thiophene-2-carbonyl)amino]methyl}phenyl 4-acetamidobenzene-1-sulfonate
Chemical Structure Depiction of
5-(diethylamino)-2-{[(2-methylpropyl)(thiophene-2-carbonyl)amino]methyl}phenyl 4-acetamidobenzene-1-sulfonate
5-(diethylamino)-2-{[(2-methylpropyl)(thiophene-2-carbonyl)amino]methyl}phenyl 4-acetamidobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V025-1346 |
| Compound Name: | 5-(diethylamino)-2-{[(2-methylpropyl)(thiophene-2-carbonyl)amino]methyl}phenyl 4-acetamidobenzene-1-sulfonate |
| Molecular Weight: | 557.73 |
| Molecular Formula: | C28 H35 N3 O5 S2 |
| Salt: | not_available |
| Smiles: | CCN(CC)c1ccc(CN(CC(C)C)C(c2cccs2)=O)c(c1)OS(c1ccc(cc1)NC(C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2285 |
| logD: | 5.2176 |
| logSw: | -5.0635 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.314 |
| InChI Key: | PQAQMUNXOYPRHL-UHFFFAOYSA-N |