N-(5-chloro-2,4-dimethoxyphenyl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
N-(5-chloro-2,4-dimethoxyphenyl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | E715-0024 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide |
| Molecular Weight: | 484.99 |
| Molecular Formula: | C24 H29 Cl N6 O3 |
| Smiles: | COc1cc(c(cc1NC(C1CCCN(C1)c1c2c(ncn1)n1CCCCCc1n2)=O)[Cl])OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6923 |
| logD: | 3.6253 |
| logSw: | -3.9956 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.183 |
| InChI Key: | ZDHZHUWWZYCUHN-HNNXBMFYSA-N |