ethyl 4-[N-(benzenesulfonyl)-N-methylalanyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-[N-(benzenesulfonyl)-N-methylalanyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-[N-(benzenesulfonyl)-N-methylalanyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V026-1607 |
| Compound Name: | ethyl 4-[N-(benzenesulfonyl)-N-methylalanyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 392.47 |
| Molecular Formula: | C19 H24 N2 O5 S |
| Salt: | not_available |
| Smiles: | CCOC(c1c(C)c(C(C(C)N(C)S(c2ccccc2)(=O)=O)=O)c(C)[nH]1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7842 |
| logD: | 2.7842 |
| logSw: | -3.2472 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.486 |
| InChI Key: | TUTQVZLTLMSBIS-AWEZNQCLSA-N |