4-benzyl-1-(3,4-dimethoxyphenyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Chemical Structure Depiction of
4-benzyl-1-(3,4-dimethoxyphenyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
4-benzyl-1-(3,4-dimethoxyphenyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Compound characteristics
| Compound ID: | E143-0021 |
| Compound Name: | 4-benzyl-1-(3,4-dimethoxyphenyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one |
| Molecular Weight: | 412.45 |
| Molecular Formula: | C24 H20 N4 O3 |
| Smiles: | COc1ccc(cc1OC)c1nnc2N(Cc3ccccc3)C(c3ccccc3n12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7533 |
| logD: | 3.7533 |
| logSw: | -4.0957 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.991 |
| InChI Key: | PKDJSMAZFPVFNT-UHFFFAOYSA-N |