ethyl 4-{[benzyl(ethanesulfonyl)amino]methyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-{[benzyl(ethanesulfonyl)amino]methyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-{[benzyl(ethanesulfonyl)amino]methyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | 8013-1113 |
| Compound Name: | ethyl 4-{[benzyl(ethanesulfonyl)amino]methyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 378.49 |
| Molecular Formula: | C19 H26 N2 O4 S |
| Smiles: | [H]n1c(C)c(CN(Cc2ccccc2)S(CC)(=O)=O)c(C)c1C(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 3.3217 |
| logD: | 3.3217 |
| logSw: | -3.551 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.243 |
| InChI Key: | PLHACRGRGSDTAP-UHFFFAOYSA-N |