N-(3-chlorophenyl)-4-[3-(2-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazine-1-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-4-[3-(2-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazine-1-carboxamide
N-(3-chlorophenyl)-4-[3-(2-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V028-6915 |
| Compound Name: | N-(3-chlorophenyl)-4-[3-(2-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazine-1-carboxamide |
| Molecular Weight: | 497.99 |
| Molecular Formula: | C27 H24 Cl N7 O |
| Salt: | not_available |
| Smiles: | Cc1ccccc1c1nnc2c3ccccc3nc(N3CCN(CC3)C(Nc3cccc(c3)[Cl])=O)n12 |
| Stereo: | ACHIRAL |
| logP: | 5.5048 |
| logD: | 5.3956 |
| logSw: | -5.8864 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.27 |
| InChI Key: | VLWWJRVPMXZRMK-UHFFFAOYSA-N |