1-[4-(8-chloro-3-phenyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)piperazin-1-yl]-3,3-dimethylbutan-1-one
Chemical Structure Depiction of
1-[4-(8-chloro-3-phenyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)piperazin-1-yl]-3,3-dimethylbutan-1-one
1-[4-(8-chloro-3-phenyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)piperazin-1-yl]-3,3-dimethylbutan-1-one
Compound characteristics
| Compound ID: | V020-0202 |
| Compound Name: | 1-[4-(8-chloro-3-phenyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)piperazin-1-yl]-3,3-dimethylbutan-1-one |
| Molecular Weight: | 462.98 |
| Molecular Formula: | C25 H27 Cl N6 O |
| Salt: | not_available |
| Smiles: | CC(C)(C)CC(N1CCN(CC1)c1nc2cc(ccc2c2nnc(c3ccccc3)n12)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.5847 |
| logD: | 5.5196 |
| logSw: | -6.0156 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.193 |
| InChI Key: | YXPFBHJPJZLMMT-UHFFFAOYSA-N |