4-{[(methanesulfonyl)(propan-2-yl)amino]methyl}phenyl ethanesulfonate
Chemical Structure Depiction of
4-{[(methanesulfonyl)(propan-2-yl)amino]methyl}phenyl ethanesulfonate
4-{[(methanesulfonyl)(propan-2-yl)amino]methyl}phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V030-1146 |
| Compound Name: | 4-{[(methanesulfonyl)(propan-2-yl)amino]methyl}phenyl ethanesulfonate |
| Molecular Weight: | 335.44 |
| Molecular Formula: | C13 H21 N O5 S2 |
| Smiles: | CCS(=O)(=O)Oc1ccc(CN(C(C)C)S(C)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.7903 |
| logD: | 1.7903 |
| logSw: | -2.4791 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 67.269 |
| InChI Key: | LJUQIHLTOQWCCK-UHFFFAOYSA-N |