methyl 4-{N-(cyclopropanecarbonyl)-N-[(4-fluorophenyl)methyl]alanyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-{N-(cyclopropanecarbonyl)-N-[(4-fluorophenyl)methyl]alanyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
methyl 4-{N-(cyclopropanecarbonyl)-N-[(4-fluorophenyl)methyl]alanyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V005-3165 |
| Compound Name: | methyl 4-{N-(cyclopropanecarbonyl)-N-[(4-fluorophenyl)methyl]alanyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 414.48 |
| Molecular Formula: | C23 H27 F N2 O4 |
| Smiles: | CC(C(c1c(C)c(C(=O)OC)n(C)c1C)=O)N(Cc1ccc(cc1)F)C(C1CC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0332 |
| logD: | 3.0332 |
| logSw: | -3.1197 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.786 |
| InChI Key: | LLXONKAQMOZZPQ-HNNXBMFYSA-N |