4-(2-methoxyphenyl)-1-sulfanyl-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Chemical Structure Depiction of
4-(2-methoxyphenyl)-1-sulfanyl-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
4-(2-methoxyphenyl)-1-sulfanyl-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Compound characteristics
| Compound ID: | 4222-0274 |
| Compound Name: | 4-(2-methoxyphenyl)-1-sulfanyl-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one |
| Molecular Weight: | 444.55 |
| Molecular Formula: | C25 H24 N4 O2 S |
| Smiles: | COc1ccccc1N1C(C2=C(c3ccccc3CC23CCCCC3)n2c1nnc2S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3583 |
| logD: | 2.6098 |
| logSw: | -4.4883 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.85 |
| InChI Key: | LGSGNWVADZDHJA-UHFFFAOYSA-N |