methyl 1-ethyl-4-{N-[(4-fluorophenyl)methyl]-N-(2-methylpropanoyl)alanyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 1-ethyl-4-{N-[(4-fluorophenyl)methyl]-N-(2-methylpropanoyl)alanyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
methyl 1-ethyl-4-{N-[(4-fluorophenyl)methyl]-N-(2-methylpropanoyl)alanyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V005-7918 |
| Compound Name: | methyl 1-ethyl-4-{N-[(4-fluorophenyl)methyl]-N-(2-methylpropanoyl)alanyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 430.52 |
| Molecular Formula: | C24 H31 F N2 O4 |
| Smiles: | CCn1c(C)c(C(C(C)N(Cc2ccc(cc2)F)C(C(C)C)=O)=O)c(C)c1C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.862 |
| logD: | 3.862 |
| logSw: | -4.2911 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.449 |
| InChI Key: | ZWYSEHXPZRYSSG-KRWDZBQOSA-N |