methyl 4-[N-(benzenesulfonyl)-N-cyclopropylalanyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-[N-(benzenesulfonyl)-N-cyclopropylalanyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
methyl 4-[N-(benzenesulfonyl)-N-cyclopropylalanyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V007-2430 |
| Compound Name: | methyl 4-[N-(benzenesulfonyl)-N-cyclopropylalanyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 432.54 |
| Molecular Formula: | C22 H28 N2 O5 S |
| Smiles: | CCn1c(C)c(C(C(C)N(C2CC2)S(c2ccccc2)(=O)=O)=O)c(C)c1C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5664 |
| logD: | 3.5664 |
| logSw: | -3.9274 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 68.102 |
| InChI Key: | SEAJTBRRGOCEFT-INIZCTEOSA-N |