N-(5-chloro-2-methylphenyl)-N-methyl-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-(5-chloro-2-methylphenyl)-N-methyl-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
N-(5-chloro-2-methylphenyl)-N-methyl-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | E715-0270 |
| Compound Name: | N-(5-chloro-2-methylphenyl)-N-methyl-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide |
| Molecular Weight: | 452.99 |
| Molecular Formula: | C24 H29 Cl N6 O |
| Smiles: | Cc1ccc(cc1N(C)C(C1CCCN(C1)c1c2c(ncn1)n1CCCCCc1n2)=O)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2912 |
| logD: | 4.2855 |
| logSw: | -4.5147 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 51.597 |
| InChI Key: | RAKFCUUAYHNIOW-KRWDZBQOSA-N |