2-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
2-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y503-4532 |
| Compound Name: | 2-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 397.89 |
| Molecular Formula: | C18 H16 Cl N7 S |
| Smiles: | Cc1cc(C)nc2c1c1c(c3nc(Cn4c(C)c(c(C)n4)[Cl])nn3cn1)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.1072 |
| logD: | 2.9616 |
| logSw: | -3.497 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 55.571 |
| InChI Key: | MXXOYQDEKVNQKL-UHFFFAOYSA-N |