5-(diethylamino)-2-{[(propan-2-yl)(thiophene-2-carbonyl)amino]methyl}phenyl ethanesulfonate
Chemical Structure Depiction of
5-(diethylamino)-2-{[(propan-2-yl)(thiophene-2-carbonyl)amino]methyl}phenyl ethanesulfonate
5-(diethylamino)-2-{[(propan-2-yl)(thiophene-2-carbonyl)amino]methyl}phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V026-6235 |
| Compound Name: | 5-(diethylamino)-2-{[(propan-2-yl)(thiophene-2-carbonyl)amino]methyl}phenyl ethanesulfonate |
| Molecular Weight: | 438.61 |
| Molecular Formula: | C21 H30 N2 O4 S2 |
| Salt: | not_available |
| Smiles: | CCN(CC)c1ccc(CN(C(C)C)C(c2cccs2)=O)c(c1)OS(CC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3213 |
| logD: | 4.3117 |
| logSw: | -4.2206 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.143 |
| InChI Key: | GSSNVMIRNYMLML-UHFFFAOYSA-N |