ethyl 4-[N-(2-chlorobenzoyl)-N-ethylalanyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-[N-(2-chlorobenzoyl)-N-ethylalanyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
ethyl 4-[N-(2-chlorobenzoyl)-N-ethylalanyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V028-1127 |
| Compound Name: | ethyl 4-[N-(2-chlorobenzoyl)-N-ethylalanyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 418.92 |
| Molecular Formula: | C22 H27 Cl N2 O4 |
| Salt: | not_available |
| Smiles: | CCN(C(C)C(c1c(C)c(C(=O)OCC)n(C)c1C)=O)C(c1ccccc1[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4215 |
| logD: | 3.4215 |
| logSw: | -4.0629 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.839 |
| InChI Key: | CVRHIPZGEBLRHB-HNNXBMFYSA-N |