2-[(4-chloro-1H-pyrazol-1-yl)methyl]-9-(difluoromethyl)-7-phenylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-[(4-chloro-1H-pyrazol-1-yl)methyl]-9-(difluoromethyl)-7-phenylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
2-[(4-chloro-1H-pyrazol-1-yl)methyl]-9-(difluoromethyl)-7-phenylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y501-1829 |
| Compound Name: | 2-[(4-chloro-1H-pyrazol-1-yl)methyl]-9-(difluoromethyl)-7-phenylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 467.89 |
| Molecular Formula: | C21 H12 Cl F2 N7 S |
| Smiles: | C(c1nc2c3c(c4c(cc(C(F)F)nc4s3)c3ccccc3)ncn2n1)n1cc(cn1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.3577 |
| logD: | 4.3544 |
| logSw: | -4.7957 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 55.717 |
| InChI Key: | CRFBARUGALFUPY-UHFFFAOYSA-N |