2-[1-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)propan-2-yl][1,2,4]triazolo[1,5-c]quinazoline
Chemical Structure Depiction of
2-[1-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)propan-2-yl][1,2,4]triazolo[1,5-c]quinazoline
2-[1-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)propan-2-yl][1,2,4]triazolo[1,5-c]quinazoline
Compound characteristics
| Compound ID: | Y502-6953 |
| Compound Name: | 2-[1-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)propan-2-yl][1,2,4]triazolo[1,5-c]quinazoline |
| Molecular Weight: | 351.37 |
| Molecular Formula: | C17 H17 N7 O2 |
| Smiles: | CC(Cn1c(C)c(c(C)n1)[N+]([O-])=O)c1nc2c3ccccc3ncn2n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0468 |
| logD: | 1.8252 |
| logSw: | -2.2043 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 77.063 |
| InChI Key: | VETJZZRNINZYTH-JTQLQIEISA-N |