(1-methyl-4-{[(4-methylphenyl)methyl]amino}[1,2,4]triazolo[4,3-a]quinoxalin-8-yl)(phenyl)methanone
Chemical Structure Depiction of
(1-methyl-4-{[(4-methylphenyl)methyl]amino}[1,2,4]triazolo[4,3-a]quinoxalin-8-yl)(phenyl)methanone
(1-methyl-4-{[(4-methylphenyl)methyl]amino}[1,2,4]triazolo[4,3-a]quinoxalin-8-yl)(phenyl)methanone
Compound characteristics
| Compound ID: | E881-0203 |
| Compound Name: | (1-methyl-4-{[(4-methylphenyl)methyl]amino}[1,2,4]triazolo[4,3-a]quinoxalin-8-yl)(phenyl)methanone |
| Molecular Weight: | 407.47 |
| Molecular Formula: | C25 H21 N5 O |
| Smiles: | Cc1ccc(CNc2c3nnc(C)n3c3cc(ccc3n2)C(c2ccccc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1765 |
| logD: | 4.1765 |
| logSw: | -4.2342 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.039 |
| InChI Key: | PTTRWXDFQJZKHA-UHFFFAOYSA-N |