N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4-methylphenyl)methyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-amine
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4-methylphenyl)methyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-amine
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4-methylphenyl)methyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-amine
Compound characteristics
| Compound ID: | G702-8366 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4-methylphenyl)methyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-amine |
| Molecular Weight: | 427.51 |
| Molecular Formula: | C25 H25 N5 O2 |
| Smiles: | Cc1ccc(Cc2nc3N=C4CCCCC4=C(Nc4ccc5c(c4)OCCO5)n3n2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1331 |
| logD: | 4.133 |
| logSw: | -4.236 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.707 |
| InChI Key: | NXCPAHHZIFGKGW-UHFFFAOYSA-N |