2-{[acetyl(cyclopropylmethyl)amino]methyl}-4-chlorophenyl ethanesulfonate
Chemical Structure Depiction of
2-{[acetyl(cyclopropylmethyl)amino]methyl}-4-chlorophenyl ethanesulfonate
2-{[acetyl(cyclopropylmethyl)amino]methyl}-4-chlorophenyl ethanesulfonate
Compound characteristics
| Compound ID: | V030-8736 |
| Compound Name: | 2-{[acetyl(cyclopropylmethyl)amino]methyl}-4-chlorophenyl ethanesulfonate |
| Molecular Weight: | 345.84 |
| Molecular Formula: | C15 H20 Cl N O4 S |
| Smiles: | CCS(=O)(=O)Oc1ccc(cc1CN(CC1CC1)C(C)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.8036 |
| logD: | 2.8036 |
| logSw: | -3.3471 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.636 |
| InChI Key: | ZMIYOLSHWPFGRC-UHFFFAOYSA-N |