ethyl 4-[N-(2-chlorobenzoyl)-N-ethylalanyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-[N-(2-chlorobenzoyl)-N-ethylalanyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-[N-(2-chlorobenzoyl)-N-ethylalanyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V005-2562 |
| Compound Name: | ethyl 4-[N-(2-chlorobenzoyl)-N-ethylalanyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 432.95 |
| Molecular Formula: | C23 H29 Cl N2 O4 |
| Smiles: | CCN(C(C)C(c1c(C)c(C(=O)OCC)n(CC)c1C)=O)C(c1ccccc1[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0394 |
| logD: | 4.0394 |
| logSw: | -4.6469 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.754 |
| InChI Key: | JCDTVTMXJKTKPZ-INIZCTEOSA-N |