1-{4-[3-(2-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1,4-diazepan-1-yl}-2-methylpropan-1-one
Chemical Structure Depiction of
1-{4-[3-(2-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1,4-diazepan-1-yl}-2-methylpropan-1-one
1-{4-[3-(2-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1,4-diazepan-1-yl}-2-methylpropan-1-one
Compound characteristics
| Compound ID: | V016-5872 |
| Compound Name: | 1-{4-[3-(2-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1,4-diazepan-1-yl}-2-methylpropan-1-one |
| Molecular Weight: | 448.95 |
| Molecular Formula: | C24 H25 Cl N6 O |
| Salt: | not_available |
| Smiles: | CC(C)C(N1CCCN(CC1)c1nc2ccccc2c2nnc(c3ccccc3[Cl])n12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4587 |
| logD: | 4.3935 |
| logSw: | -4.5241 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.052 |
| InChI Key: | BVHMPJGRGQHLMV-UHFFFAOYSA-N |