8-chloro-2-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-4-propyl-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione
Chemical Structure Depiction of
8-chloro-2-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-4-propyl-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione
8-chloro-2-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-4-propyl-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione
Compound characteristics
| Compound ID: | F366-0404 |
| Compound Name: | 8-chloro-2-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-4-propyl-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione |
| Molecular Weight: | 456.88 |
| Molecular Formula: | C22 H21 Cl N4 O5 |
| Smiles: | CCCN1C2=NN(CC(c3ccc(c(c3)OC)OC)=O)C(N2c2cc(ccc2C1=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.1621 |
| logD: | 3.1621 |
| logSw: | -3.4873 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 76.693 |
| InChI Key: | LVBAEFOVAKJXQW-UHFFFAOYSA-N |