9-(difluoromethyl)-7-methyl-2-(phenoxymethyl)pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
9-(difluoromethyl)-7-methyl-2-(phenoxymethyl)pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
9-(difluoromethyl)-7-methyl-2-(phenoxymethyl)pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | D643-0112 |
| Compound Name: | 9-(difluoromethyl)-7-methyl-2-(phenoxymethyl)pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 397.4 |
| Molecular Formula: | C19 H13 F2 N5 O S |
| Smiles: | Cc1cc(C(F)F)nc2c1c1c(c3nc(COc4ccccc4)nn3cn1)s2 |
| Stereo: | ACHIRAL |
| logP: | 4.0593 |
| logD: | 4.058 |
| logSw: | -4.3522 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.71 |
| InChI Key: | ADQAHXMLYZYAFP-UHFFFAOYSA-N |