methyl 4-({1-[2-(4-fluorophenyl)ethyl]-5-oxopyrrolidine-3-carbonyl}amino)benzoate
Chemical Structure Depiction of
methyl 4-({1-[2-(4-fluorophenyl)ethyl]-5-oxopyrrolidine-3-carbonyl}amino)benzoate
methyl 4-({1-[2-(4-fluorophenyl)ethyl]-5-oxopyrrolidine-3-carbonyl}amino)benzoate
Compound characteristics
| Compound ID: | Y031-4225 |
| Compound Name: | methyl 4-({1-[2-(4-fluorophenyl)ethyl]-5-oxopyrrolidine-3-carbonyl}amino)benzoate |
| Molecular Weight: | 384.41 |
| Molecular Formula: | C21 H21 F N2 O4 |
| Smiles: | COC(c1ccc(cc1)NC(C1CC(N(CCc2ccc(cc2)F)C1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2206 |
| logD: | 2.22 |
| logSw: | -2.8373 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.678 |
| InChI Key: | IMKWYSKCXIOMTP-MRXNPFEDSA-N |