4-(4-methoxyphenyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclopentan]-5(7H)-one
Chemical Structure Depiction of
4-(4-methoxyphenyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclopentan]-5(7H)-one
4-(4-methoxyphenyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclopentan]-5(7H)-one
Compound characteristics
| Compound ID: | 4232-0032 |
| Compound Name: | 4-(4-methoxyphenyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclopentan]-5(7H)-one |
| Molecular Weight: | 398.46 |
| Molecular Formula: | C24 H22 N4 O2 |
| Smiles: | COc1ccc(cc1)N1C(C2=C(c3ccccc3CC23CCCC3)n2cnnc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7921 |
| logD: | 3.7921 |
| logSw: | -3.9573 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 46.826 |
| InChI Key: | XITTUKGHCYATRF-UHFFFAOYSA-N |