2-{[acetyl(cyclopropylmethyl)amino]methyl}-5-(diethylamino)phenyl ethanesulfonate
Chemical Structure Depiction of
2-{[acetyl(cyclopropylmethyl)amino]methyl}-5-(diethylamino)phenyl ethanesulfonate
2-{[acetyl(cyclopropylmethyl)amino]methyl}-5-(diethylamino)phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V030-3586 |
| Compound Name: | 2-{[acetyl(cyclopropylmethyl)amino]methyl}-5-(diethylamino)phenyl ethanesulfonate |
| Molecular Weight: | 382.52 |
| Molecular Formula: | C19 H30 N2 O4 S |
| Salt: | not_available |
| Smiles: | CCN(CC)c1ccc(CN(CC2CC2)C(C)=O)c(c1)OS(CC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0319 |
| logD: | 3.0224 |
| logSw: | -3.3208 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.372 |
| InChI Key: | PCQHUTCTQNWYSC-UHFFFAOYSA-N |