methyl 4-[N-(benzenesulfonyl)-N-(3-ethoxypropyl)alanyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-[N-(benzenesulfonyl)-N-(3-ethoxypropyl)alanyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
methyl 4-[N-(benzenesulfonyl)-N-(3-ethoxypropyl)alanyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V005-2552 |
| Compound Name: | methyl 4-[N-(benzenesulfonyl)-N-(3-ethoxypropyl)alanyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 464.58 |
| Molecular Formula: | C23 H32 N2 O6 S |
| Smiles: | CCOCCCN(C(C)C(c1c(C)c(C(=O)OC)n(C)c1C)=O)S(c1ccccc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7612 |
| logD: | 2.7612 |
| logSw: | -3.1369 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 76.693 |
| InChI Key: | DSZDMCODUXMDPB-SFHVURJKSA-N |