2-{[(cyclopropylmethyl)(thiophene-2-carbonyl)amino]methyl}-5-(diethylamino)phenyl ethanesulfonate
Chemical Structure Depiction of
2-{[(cyclopropylmethyl)(thiophene-2-carbonyl)amino]methyl}-5-(diethylamino)phenyl ethanesulfonate
2-{[(cyclopropylmethyl)(thiophene-2-carbonyl)amino]methyl}-5-(diethylamino)phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V030-3622 |
| Compound Name: | 2-{[(cyclopropylmethyl)(thiophene-2-carbonyl)amino]methyl}-5-(diethylamino)phenyl ethanesulfonate |
| Molecular Weight: | 450.62 |
| Molecular Formula: | C22 H30 N2 O4 S2 |
| Salt: | not_available |
| Smiles: | CCN(CC)c1ccc(CN(CC2CC2)C(c2cccs2)=O)c(c1)OS(CC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4554 |
| logD: | 4.4459 |
| logSw: | -4.3283 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.651 |
| InChI Key: | BQJROWRAYJXHHJ-UHFFFAOYSA-N |