methyl 4-[N-(benzenesulfonyl)-N-(2-methylpropyl)alanyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-[N-(benzenesulfonyl)-N-(2-methylpropyl)alanyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
methyl 4-[N-(benzenesulfonyl)-N-(2-methylpropyl)alanyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V005-2561 |
| Compound Name: | methyl 4-[N-(benzenesulfonyl)-N-(2-methylpropyl)alanyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 448.58 |
| Molecular Formula: | C23 H32 N2 O5 S |
| Smiles: | CCn1c(C)c(C(C(C)N(CC(C)C)S(c2ccccc2)(=O)=O)=O)c(C)c1C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1159 |
| logD: | 4.1159 |
| logSw: | -4.2618 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 67.652 |
| InChI Key: | MLPBOLUOXBCHCG-SFHVURJKSA-N |