methyl 4-[N-(3-ethoxypropyl)-N-(4-methylbenzene-1-sulfonyl)alanyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-[N-(3-ethoxypropyl)-N-(4-methylbenzene-1-sulfonyl)alanyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
methyl 4-[N-(3-ethoxypropyl)-N-(4-methylbenzene-1-sulfonyl)alanyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V005-2564 |
| Compound Name: | methyl 4-[N-(3-ethoxypropyl)-N-(4-methylbenzene-1-sulfonyl)alanyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 478.61 |
| Molecular Formula: | C24 H34 N2 O6 S |
| Smiles: | CCOCCCN(C(C)C(c1c(C)c(C(=O)OC)n(C)c1C)=O)S(c1ccc(C)cc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3697 |
| logD: | 3.3697 |
| logSw: | -3.7712 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 76.693 |
| InChI Key: | RJKJAIFCBQWMMP-IBGZPJMESA-N |