N-(5-chloro-2-methoxyphenyl)-N-methyl-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-(5-chloro-2-methoxyphenyl)-N-methyl-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-4-carboxamide
N-(5-chloro-2-methoxyphenyl)-N-methyl-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E715-0636 |
| Compound Name: | N-(5-chloro-2-methoxyphenyl)-N-methyl-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-4-carboxamide |
| Molecular Weight: | 468.99 |
| Molecular Formula: | C24 H29 Cl N6 O2 |
| Smiles: | CN(C(C1CCN(CC1)c1c2c(ncn1)n1CCCCCc1n2)=O)c1cc(ccc1OC)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.8015 |
| logD: | 3.7957 |
| logSw: | -4.3498 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 59.294 |
| InChI Key: | OHIGQQHZTOVFIC-UHFFFAOYSA-N |