methyl 4-{N-(4-fluorobenzoyl)-N-[(pyridin-3-yl)methyl]alanyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-{N-(4-fluorobenzoyl)-N-[(pyridin-3-yl)methyl]alanyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
methyl 4-{N-(4-fluorobenzoyl)-N-[(pyridin-3-yl)methyl]alanyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V028-8976 |
| Compound Name: | methyl 4-{N-(4-fluorobenzoyl)-N-[(pyridin-3-yl)methyl]alanyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 437.47 |
| Molecular Formula: | C24 H24 F N3 O4 |
| Salt: | not_available |
| Smiles: | CC(C(c1c(C)c(C(=O)OC)[nH]c1C)=O)N(Cc1cccnc1)C(c1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6789 |
| logD: | 2.6789 |
| logSw: | -2.5346 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.954 |
| InChI Key: | YMJQTCNRNKWOBU-INIZCTEOSA-N |