methyl 3-{[4-(2-{[(2-fluorophenyl)methyl]amino}-2-oxoethyl)piperidine-1-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 3-{[4-(2-{[(2-fluorophenyl)methyl]amino}-2-oxoethyl)piperidine-1-carbonyl]amino}benzoate
methyl 3-{[4-(2-{[(2-fluorophenyl)methyl]amino}-2-oxoethyl)piperidine-1-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | F345-1599 |
| Compound Name: | methyl 3-{[4-(2-{[(2-fluorophenyl)methyl]amino}-2-oxoethyl)piperidine-1-carbonyl]amino}benzoate |
| Molecular Weight: | 427.47 |
| Molecular Formula: | C23 H26 F N3 O4 |
| Smiles: | COC(c1cccc(c1)NC(N1CCC(CC1)CC(NCc1ccccc1F)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8342 |
| logD: | 3.8342 |
| logSw: | -4.082 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.081 |
| InChI Key: | QZLMZPMGQSSIRO-UHFFFAOYSA-N |