N-(4-fluorophenyl)-N-propyl-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-N-propyl-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
N-(4-fluorophenyl)-N-propyl-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | E715-0282 |
| Compound Name: | N-(4-fluorophenyl)-N-propyl-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide |
| Molecular Weight: | 450.56 |
| Molecular Formula: | C25 H31 F N6 O |
| Smiles: | CCCN(C(C1CCCN(C1)c1c2c(ncn1)n1CCCCCc1n2)=O)c1ccc(cc1)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3037 |
| logD: | 4.2979 |
| logSw: | -4.2232 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 52.13 |
| InChI Key: | AMHADHDRHSEWCN-SFHVURJKSA-N |