(4-methyl-3-nitrophenyl)[4-(3-methyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)piperazin-1-yl]methanone
Chemical Structure Depiction of
(4-methyl-3-nitrophenyl)[4-(3-methyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)piperazin-1-yl]methanone
(4-methyl-3-nitrophenyl)[4-(3-methyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | V028-5971 |
| Compound Name: | (4-methyl-3-nitrophenyl)[4-(3-methyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)piperazin-1-yl]methanone |
| Molecular Weight: | 431.45 |
| Molecular Formula: | C22 H21 N7 O3 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1[N+]([O-])=O)C(N1CCN(CC1)c1nc2ccccc2c2nnc(C)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5353 |
| logD: | 2.39 |
| logSw: | -2.7863 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 83.578 |
| InChI Key: | RNMVAUOEKMZYJJ-UHFFFAOYSA-N |