N-(3-chloro-2-methylphenyl)-1-(3,6,7,8,9,10-hexahydro-4H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-1-(3,6,7,8,9,10-hexahydro-4H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
N-(3-chloro-2-methylphenyl)-1-(3,6,7,8,9,10-hexahydro-4H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | E715-0232 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-1-(3,6,7,8,9,10-hexahydro-4H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide |
| Molecular Weight: | 440.98 |
| Molecular Formula: | C23 H29 Cl N6 O |
| Smiles: | Cc1c(cccc1[Cl])NC(C1CCCN(C1)C1c2c(N=CN1)n1CCCCCc1n2)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.4999 |
| logD: | 0.1047 |
| logSw: | -3.7342 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.29 |
| InChI Key: | FUHUCRPROBQEPZ-UHFFFAOYSA-N |