[4-(3-cyclohexyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-2-methylpiperazin-1-yl](4-methyl-3-nitrophenyl)methanone
Chemical Structure Depiction of
[4-(3-cyclohexyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-2-methylpiperazin-1-yl](4-methyl-3-nitrophenyl)methanone
[4-(3-cyclohexyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-2-methylpiperazin-1-yl](4-methyl-3-nitrophenyl)methanone
Compound characteristics
| Compound ID: | V014-8106 |
| Compound Name: | [4-(3-cyclohexyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-2-methylpiperazin-1-yl](4-methyl-3-nitrophenyl)methanone |
| Molecular Weight: | 513.6 |
| Molecular Formula: | C28 H31 N7 O3 |
| Salt: | not_available |
| Smiles: | CC1CN(CCN1C(c1ccc(C)c(c1)[N+]([O-])=O)=O)c1nc2ccccc2c2nnc(C3CCCCC3)n12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2899 |
| logD: | 5.2897 |
| logSw: | -5.5333 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 81.94 |
| InChI Key: | LQIUAOQSLXGLHB-IBGZPJMESA-N |