5-(diethylamino)-2-{[(propan-2-yl)(thiophene-2-carbonyl)amino]methyl}phenyl methanesulfonate
Chemical Structure Depiction of
5-(diethylamino)-2-{[(propan-2-yl)(thiophene-2-carbonyl)amino]methyl}phenyl methanesulfonate
5-(diethylamino)-2-{[(propan-2-yl)(thiophene-2-carbonyl)amino]methyl}phenyl methanesulfonate
Compound characteristics
| Compound ID: | V026-5795 |
| Compound Name: | 5-(diethylamino)-2-{[(propan-2-yl)(thiophene-2-carbonyl)amino]methyl}phenyl methanesulfonate |
| Molecular Weight: | 424.58 |
| Molecular Formula: | C20 H28 N2 O4 S2 |
| Salt: | not_available |
| Smiles: | CCN(CC)c1ccc(CN(C(C)C)C(c2cccs2)=O)c(c1)OS(C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9575 |
| logD: | 3.9479 |
| logSw: | -3.8317 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.183 |
| InChI Key: | NOHVHRQFXOIKJR-UHFFFAOYSA-N |