N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | E715-0138 |
| Compound Name: | N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide |
| Molecular Weight: | 426.54 |
| Molecular Formula: | C20 H26 N8 O S |
| Smiles: | CCc1nnc(NC(C2CCCN(C2)c2c3c(ncn2)n2CCCCCc2n3)=O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8646 |
| logD: | 2.561 |
| logSw: | -3.0748 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.66 |
| InChI Key: | MVFBCGJKHZMAJA-ZDUSSCGKSA-N |