4-[8-chloro-3-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-N-(3-chlorophenyl)piperazine-1-carboxamide
Chemical Structure Depiction of
4-[8-chloro-3-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-N-(3-chlorophenyl)piperazine-1-carboxamide
4-[8-chloro-3-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-N-(3-chlorophenyl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V025-0259 |
| Compound Name: | 4-[8-chloro-3-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-N-(3-chlorophenyl)piperazine-1-carboxamide |
| Molecular Weight: | 532.43 |
| Molecular Formula: | C27 H23 Cl2 N7 O |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)c1nnc2c3ccc(cc3nc(N3CCN(CC3)C(Nc3cccc(c3)[Cl])=O)n12)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.6963 |
| logD: | 6.4156 |
| logSw: | -6.3418 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.27 |
| InChI Key: | XCWJDMXLFWOKNJ-UHFFFAOYSA-N |