cyclopropyl{4-[3-(4-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}methanone
Chemical Structure Depiction of
cyclopropyl{4-[3-(4-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}methanone
cyclopropyl{4-[3-(4-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}methanone
Compound characteristics
| Compound ID: | V028-5901 |
| Compound Name: | cyclopropyl{4-[3-(4-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}methanone |
| Molecular Weight: | 443.46 |
| Molecular Formula: | C23 H21 N7 O3 |
| Salt: | not_available |
| Smiles: | C1CC1C(N1CCN(CC1)c1nc2ccccc2c2nnc(c3ccc(cc3)[N+]([O-])=O)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6735 |
| logD: | 3.6124 |
| logSw: | -4.1448 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 83.354 |
| InChI Key: | OWDYDGSLURRVPC-UHFFFAOYSA-N |