methyl 4-[N-(2-chlorobenzoyl)-N-(3-ethoxypropyl)alanyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-[N-(2-chlorobenzoyl)-N-(3-ethoxypropyl)alanyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
methyl 4-[N-(2-chlorobenzoyl)-N-(3-ethoxypropyl)alanyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V025-2649 |
| Compound Name: | methyl 4-[N-(2-chlorobenzoyl)-N-(3-ethoxypropyl)alanyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 462.97 |
| Molecular Formula: | C24 H31 Cl N2 O5 |
| Smiles: | CCOCCCN(C(C)C(c1c(C)c(C(=O)OC)n(C)c1C)=O)C(c1ccccc1[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2194 |
| logD: | 3.2194 |
| logSw: | -3.8878 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.49 |
| InChI Key: | YDBMKUFKUUSCTG-KRWDZBQOSA-N |