1-(azepan-1-yl)-2-[5,7-bis(4-methylphenyl)tetrazolo[1,5-a]pyrimidin-4(7H)-yl]ethan-1-one
Chemical Structure Depiction of
1-(azepan-1-yl)-2-[5,7-bis(4-methylphenyl)tetrazolo[1,5-a]pyrimidin-4(7H)-yl]ethan-1-one
1-(azepan-1-yl)-2-[5,7-bis(4-methylphenyl)tetrazolo[1,5-a]pyrimidin-4(7H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | D530-0413 |
| Compound Name: | 1-(azepan-1-yl)-2-[5,7-bis(4-methylphenyl)tetrazolo[1,5-a]pyrimidin-4(7H)-yl]ethan-1-one |
| Molecular Weight: | 442.56 |
| Molecular Formula: | C26 H30 N6 O |
| Smiles: | Cc1ccc(cc1)C1C=C(c2ccc(C)cc2)N(CC(N2CCCCCC2)=O)c2nnnn12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9143 |
| logD: | 4.9143 |
| logSw: | -4.4934 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 57.32 |
| InChI Key: | OKPLQPLVKFTDMB-XMMPIXPASA-N |