methyl 4-[(4-{4-[(3-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}piperidine-1-carbonyl)amino]benzoate
Chemical Structure Depiction of
methyl 4-[(4-{4-[(3-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}piperidine-1-carbonyl)amino]benzoate
methyl 4-[(4-{4-[(3-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}piperidine-1-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | G909-0270 |
| Compound Name: | methyl 4-[(4-{4-[(3-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}piperidine-1-carbonyl)amino]benzoate |
| Molecular Weight: | 482.51 |
| Molecular Formula: | C25 H27 F N4 O5 |
| Smiles: | COC(c1ccc(cc1)NC(N1CCC(CC1)N1CCN(Cc2cccc(c2)F)C(C1=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.752 |
| logD: | 2.752 |
| logSw: | -3.2701 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.121 |
| InChI Key: | HZYSSVLLCJWEKB-UHFFFAOYSA-N |