methyl 2-{[4-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)piperidine-1-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[4-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)piperidine-1-carbonyl]amino}benzoate
methyl 2-{[4-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)piperidine-1-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | F345-1348 |
| Compound Name: | methyl 2-{[4-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)piperidine-1-carbonyl]amino}benzoate |
| Molecular Weight: | 427.47 |
| Molecular Formula: | C23 H26 F N3 O4 |
| Smiles: | COC(c1ccccc1NC(N1CCC(CC1)CC(NCc1ccc(cc1)F)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3381 |
| logD: | 3.3373 |
| logSw: | -3.782 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.383 |
| InChI Key: | OHUWZPDYRGZEMU-UHFFFAOYSA-N |