methyl N-{3-[(4-fluoro-N-phenylbenzamido)methyl]-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carbonyl}alaninate
Chemical Structure Depiction of
methyl N-{3-[(4-fluoro-N-phenylbenzamido)methyl]-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carbonyl}alaninate
methyl N-{3-[(4-fluoro-N-phenylbenzamido)methyl]-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carbonyl}alaninate
Compound characteristics
| Compound ID: | L870-0113 |
| Compound Name: | methyl N-{3-[(4-fluoro-N-phenylbenzamido)methyl]-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carbonyl}alaninate |
| Molecular Weight: | 493.54 |
| Molecular Formula: | C26 H28 F N5 O4 |
| Smiles: | CC(C(=O)OC)NC(N1CCc2c(C1)c(CN(C(c1ccc(cc1)F)=O)c1ccccc1)nn2C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5071 |
| logD: | 2.5071 |
| logSw: | -2.6529 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.164 |
| InChI Key: | TXHRQUSWIOVXAT-KRWDZBQOSA-N |