N-(4-chloro-2-methoxy-5-methylphenyl)-3-methyl[1,2,4]triazolo[4,3-c]quinazolin-5-amine
Chemical Structure Depiction of
N-(4-chloro-2-methoxy-5-methylphenyl)-3-methyl[1,2,4]triazolo[4,3-c]quinazolin-5-amine
N-(4-chloro-2-methoxy-5-methylphenyl)-3-methyl[1,2,4]triazolo[4,3-c]quinazolin-5-amine
Compound characteristics
| Compound ID: | E881-0005 |
| Compound Name: | N-(4-chloro-2-methoxy-5-methylphenyl)-3-methyl[1,2,4]triazolo[4,3-c]quinazolin-5-amine |
| Molecular Weight: | 353.81 |
| Molecular Formula: | C18 H16 Cl N5 O |
| Smiles: | Cc1cc(c(cc1[Cl])OC)Nc1nc2ccccc2c2nnc(C)n12 |
| Stereo: | ACHIRAL |
| logP: | 4.2034 |
| logD: | 3.9772 |
| logSw: | -4.4878 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.801 |
| InChI Key: | HPVUENSEFZNIPY-UHFFFAOYSA-N |