1-{4-[8-chloro-3-(2-chlorophenyl)[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-(2-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-3,3-dimethylbutan-1-one
1-{4-[8-chloro-3-(2-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-3,3-dimethylbutan-1-one
Compound characteristics
| Compound ID: | V022-7028 |
| Compound Name: | 1-{4-[8-chloro-3-(2-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-3,3-dimethylbutan-1-one |
| Molecular Weight: | 497.43 |
| Molecular Formula: | C25 H26 Cl2 N6 O |
| Salt: | not_available |
| Smiles: | CC(C)(C)CC(N1CCN(CC1)c1nc2cc(ccc2c2nnc(c3ccccc3[Cl])n12)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.9215 |
| logD: | 5.8563 |
| logSw: | -5.9027 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.193 |
| InChI Key: | SPDLFVKQNLKUOB-UHFFFAOYSA-N |