1-{7-[(2-fluorophenyl)methyl]-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}piperidine-4-carboxamide
Chemical Structure Depiction of
1-{7-[(2-fluorophenyl)methyl]-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}piperidine-4-carboxamide
1-{7-[(2-fluorophenyl)methyl]-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | D226-0094 |
| Compound Name: | 1-{7-[(2-fluorophenyl)methyl]-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}piperidine-4-carboxamide |
| Molecular Weight: | 400.41 |
| Molecular Formula: | C19 H21 F N6 O3 |
| Smiles: | CN1C(NC(c2c1nc(N1CCC(CC1)C(N)=O)n2Cc1ccccc1F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7814 |
| logD: | 1.7814 |
| logSw: | -2.3444 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 88.67 |
| InChI Key: | DNQHBRKFWLNIOV-UHFFFAOYSA-N |