8,9-dimethoxy-5-{[(3-methoxyphenyl)methyl]sulfanyl}-2-[2-(2-methyl-1H-benzimidazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazoline
Chemical Structure Depiction of
8,9-dimethoxy-5-{[(3-methoxyphenyl)methyl]sulfanyl}-2-[2-(2-methyl-1H-benzimidazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazoline
8,9-dimethoxy-5-{[(3-methoxyphenyl)methyl]sulfanyl}-2-[2-(2-methyl-1H-benzimidazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazoline
Compound characteristics
| Compound ID: | C445-0331 |
| Compound Name: | 8,9-dimethoxy-5-{[(3-methoxyphenyl)methyl]sulfanyl}-2-[2-(2-methyl-1H-benzimidazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazoline |
| Molecular Weight: | 540.64 |
| Molecular Formula: | C29 H28 N6 O3 S |
| Smiles: | Cc1nc2ccccc2n1CCc1nc2c3cc(c(cc3nc(n2n1)SCc1cccc(c1)OC)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 5.1716 |
| logD: | 5.0306 |
| logSw: | -5.256 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.548 |
| InChI Key: | NAYYMAKADMNMNR-UHFFFAOYSA-N |