9-(2,4-dichlorophenyl)-2,6,6-trimethyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Chemical Structure Depiction of
9-(2,4-dichlorophenyl)-2,6,6-trimethyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
9-(2,4-dichlorophenyl)-2,6,6-trimethyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Compound characteristics
| Compound ID: | Y021-1830 |
| Compound Name: | 9-(2,4-dichlorophenyl)-2,6,6-trimethyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one |
| Molecular Weight: | 377.27 |
| Molecular Formula: | C18 H18 Cl2 N4 O |
| Smiles: | Cc1nc2NC3CC(C)(C)CC(C=3C(c3ccc(cc3[Cl])[Cl])n2n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3619 |
| logD: | 3.2784 |
| logSw: | -4.4165 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.229 |
| InChI Key: | SQQCMRQOCTVUPP-INIZCTEOSA-N |