2-methoxy-1-{2-methyl-4-[3-(2-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-methoxy-1-{2-methyl-4-[3-(2-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}ethan-1-one
2-methoxy-1-{2-methyl-4-[3-(2-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | V023-9487 |
| Compound Name: | 2-methoxy-1-{2-methyl-4-[3-(2-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 461.48 |
| Molecular Formula: | C23 H23 N7 O4 |
| Salt: | not_available |
| Smiles: | CC1CN(CCN1C(COC)=O)c1nc2ccccc2c2nnc(c3ccccc3[N+]([O-])=O)n12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3906 |
| logD: | 2.3846 |
| logSw: | -2.8483 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 89.916 |
| InChI Key: | KCWABXNFNIJZJO-HNNXBMFYSA-N |