7,9-dimethyl-2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
7,9-dimethyl-2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
7,9-dimethyl-2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | D643-0017 |
| Compound Name: | 7,9-dimethyl-2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 417.53 |
| Molecular Formula: | C23 H23 N5 O S |
| Smiles: | CC(C)c1ccc(C)cc1OCc1nc2c3c(c4c(C)cc(C)nc4s3)ncn2n1 |
| Stereo: | ACHIRAL |
| logP: | 5.6162 |
| logD: | 5.4706 |
| logSw: | -5.7436 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.603 |
| InChI Key: | QMNUDLVEAFTVIR-UHFFFAOYSA-N |