4-(3-methylphenyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Chemical Structure Depiction of
4-(3-methylphenyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
4-(3-methylphenyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Compound characteristics
| Compound ID: | 8012-6654 |
| Compound Name: | 4-(3-methylphenyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one |
| Molecular Weight: | 396.49 |
| Molecular Formula: | C25 H24 N4 O |
| Smiles: | Cc1cccc(c1)N1C(C2=C(c3ccccc3CC23CCCCC3)n2cnnc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7468 |
| logD: | 4.7468 |
| logSw: | -4.5269 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 38.917 |
| InChI Key: | KPZGTLUVMFUIMT-UHFFFAOYSA-N |