1-{3-[(2-methyl-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-yl)amino]phenyl}ethan-1-one
Chemical Structure Depiction of
1-{3-[(2-methyl-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-yl)amino]phenyl}ethan-1-one
1-{3-[(2-methyl-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-yl)amino]phenyl}ethan-1-one
Compound characteristics
| Compound ID: | G702-2135 |
| Compound Name: | 1-{3-[(2-methyl-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-yl)amino]phenyl}ethan-1-one |
| Molecular Weight: | 321.38 |
| Molecular Formula: | C18 H19 N5 O |
| Smiles: | CC(c1cccc(c1)NC1=C2CCCCC2=Nc2nc(C)nn12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8088 |
| logD: | 2.8087 |
| logSw: | -3.2869 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.604 |
| InChI Key: | VUADDVJCRXVSHD-UHFFFAOYSA-N |