9-(difluoromethyl)-7-methyl-2-(2-nitrophenyl)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-(2-nitrophenyl)pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
9-(difluoromethyl)-7-methyl-2-(2-nitrophenyl)pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y509-0902 |
| Compound Name: | 9-(difluoromethyl)-7-methyl-2-(2-nitrophenyl)pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 412.38 |
| Molecular Formula: | C18 H10 F2 N6 O2 S |
| Smiles: | Cc1cc(C(F)F)nc2c1c1c(c3nc(c4ccccc4[N+]([O-])=O)nn3cn1)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.9347 |
| logD: | 3.931 |
| logSw: | -4.2951 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 73.301 |
| InChI Key: | VEESCOHRXSJACZ-UHFFFAOYSA-N |