methyl 1-ethyl-4-[N-(2-methoxyethyl)-N-(4-methylbenzene-1-sulfonyl)alanyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 1-ethyl-4-[N-(2-methoxyethyl)-N-(4-methylbenzene-1-sulfonyl)alanyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
methyl 1-ethyl-4-[N-(2-methoxyethyl)-N-(4-methylbenzene-1-sulfonyl)alanyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V024-5347 |
| Compound Name: | methyl 1-ethyl-4-[N-(2-methoxyethyl)-N-(4-methylbenzene-1-sulfonyl)alanyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 464.58 |
| Molecular Formula: | C23 H32 N2 O6 S |
| Smiles: | CCn1c(C)c(C(C(C)N(CCOC)S(c2ccc(C)cc2)(=O)=O)=O)c(C)c1C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3686 |
| logD: | 3.3686 |
| logSw: | -3.7419 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 75.973 |
| InChI Key: | HUWSLOWHSQMHCA-SFHVURJKSA-N |