ethyl 4-{N-(cyclopropanecarbonyl)-N-[(4-fluorophenyl)methyl]alanyl}-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-{N-(cyclopropanecarbonyl)-N-[(4-fluorophenyl)methyl]alanyl}-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-{N-(cyclopropanecarbonyl)-N-[(4-fluorophenyl)methyl]alanyl}-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V005-5878 |
| Compound Name: | ethyl 4-{N-(cyclopropanecarbonyl)-N-[(4-fluorophenyl)methyl]alanyl}-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 442.53 |
| Molecular Formula: | C25 H31 F N2 O4 |
| Smiles: | CCn1c(C)c(C(C(C)N(Cc2ccc(cc2)F)C(C2CC2)=O)=O)c(C)c1C(=O)OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0011 |
| logD: | 4.0011 |
| logSw: | -4.1842 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.28 |
| InChI Key: | IXJUJVRXAPWOHL-KRWDZBQOSA-N |