5-{[(4-tert-butylphenyl)methyl]sulfanyl}-8,9-dimethoxy-2-methyl[1,2,4]triazolo[1,5-c]quinazoline
Chemical Structure Depiction of
5-{[(4-tert-butylphenyl)methyl]sulfanyl}-8,9-dimethoxy-2-methyl[1,2,4]triazolo[1,5-c]quinazoline
5-{[(4-tert-butylphenyl)methyl]sulfanyl}-8,9-dimethoxy-2-methyl[1,2,4]triazolo[1,5-c]quinazoline
Compound characteristics
| Compound ID: | C445-0020 |
| Compound Name: | 5-{[(4-tert-butylphenyl)methyl]sulfanyl}-8,9-dimethoxy-2-methyl[1,2,4]triazolo[1,5-c]quinazoline |
| Molecular Weight: | 422.55 |
| Molecular Formula: | C23 H26 N4 O2 S |
| Smiles: | Cc1nc2c3cc(c(cc3nc(n2n1)SCc1ccc(cc1)C(C)(C)C)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 5.0197 |
| logD: | 4.9764 |
| logSw: | -4.8251 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.942 |
| InChI Key: | HZMXRPNURHYTJP-UHFFFAOYSA-N |