2,6,6-trimethyl-9-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Chemical Structure Depiction of
2,6,6-trimethyl-9-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
2,6,6-trimethyl-9-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Compound characteristics
| Compound ID: | Y020-7141 |
| Compound Name: | 2,6,6-trimethyl-9-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one |
| Molecular Weight: | 308.38 |
| Molecular Formula: | C18 H20 N4 O |
| Smiles: | Cc1nc2NC3CC(C)(C)CC(C=3C(c3ccccc3)n2n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9398 |
| logD: | 1.7044 |
| logSw: | -3.2482 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.229 |
| InChI Key: | BUHILMBBYCSUBJ-INIZCTEOSA-N |