methyl 4-{N-[(4-fluorophenyl)methyl]-N-(2-methylpropanoyl)alanyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-{N-[(4-fluorophenyl)methyl]-N-(2-methylpropanoyl)alanyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
methyl 4-{N-[(4-fluorophenyl)methyl]-N-(2-methylpropanoyl)alanyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V005-3153 |
| Compound Name: | methyl 4-{N-[(4-fluorophenyl)methyl]-N-(2-methylpropanoyl)alanyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 416.49 |
| Molecular Formula: | C23 H29 F N2 O4 |
| Smiles: | CC(C)C(N(Cc1ccc(cc1)F)C(C)C(c1c(C)c(C(=O)OC)n(C)c1C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2441 |
| logD: | 3.2441 |
| logSw: | -3.4533 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.534 |
| InChI Key: | AAURKTNNGURXIQ-INIZCTEOSA-N |