cyclobutyl{2-methyl-4-[3-(2-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}methanone
Chemical Structure Depiction of
cyclobutyl{2-methyl-4-[3-(2-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}methanone
cyclobutyl{2-methyl-4-[3-(2-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}methanone
Compound characteristics
| Compound ID: | V023-9538 |
| Compound Name: | cyclobutyl{2-methyl-4-[3-(2-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}methanone |
| Molecular Weight: | 471.52 |
| Molecular Formula: | C25 H25 N7 O3 |
| Salt: | not_available |
| Smiles: | CC1CN(CCN1C(C1CCC1)=O)c1nc2ccccc2c2nnc(c3ccccc3[N+]([O-])=O)n12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2816 |
| logD: | 3.2756 |
| logSw: | -3.7372 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 82.271 |
| InChI Key: | LONVLHQIBYOQGP-INIZCTEOSA-N |