1-{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxopropyl}-4-methyl[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Chemical Structure Depiction of
1-{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxopropyl}-4-methyl[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
1-{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxopropyl}-4-methyl[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Compound characteristics
| Compound ID: | C741-0889 |
| Compound Name: | 1-{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxopropyl}-4-methyl[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one |
| Molecular Weight: | 444.54 |
| Molecular Formula: | C25 H28 N6 O2 |
| Smiles: | Cc1cccc(c1C)N1CCN(CC1)C(CCc1nnc2N(C)C(c3ccccc3n12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3346 |
| logD: | 2.3345 |
| logSw: | -2.6724 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 59.095 |
| InChI Key: | UKTKKGFDSMIQCY-UHFFFAOYSA-N |