N-methyl-N-(2-methylphenyl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-methyl-N-(2-methylphenyl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-4-carboxamide
N-methyl-N-(2-methylphenyl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E715-0630 |
| Compound Name: | N-methyl-N-(2-methylphenyl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-4-carboxamide |
| Molecular Weight: | 418.54 |
| Molecular Formula: | C24 H30 N6 O |
| Smiles: | Cc1ccccc1N(C)C(C1CCN(CC1)c1c2c(ncn1)n1CCCCCc1n2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8016 |
| logD: | 3.7958 |
| logSw: | -3.9064 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 51.664 |
| InChI Key: | AWJHAZKHCWQFPZ-UHFFFAOYSA-N |