8,9-dimethyl-2-[1-(4-nitro-1H-pyrazol-1-yl)propan-2-yl]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
8,9-dimethyl-2-[1-(4-nitro-1H-pyrazol-1-yl)propan-2-yl]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
8,9-dimethyl-2-[1-(4-nitro-1H-pyrazol-1-yl)propan-2-yl]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y502-8996 |
| Compound Name: | 8,9-dimethyl-2-[1-(4-nitro-1H-pyrazol-1-yl)propan-2-yl]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 357.39 |
| Molecular Formula: | C15 H15 N7 O2 S |
| Smiles: | CC(Cn1cc(cn1)[N+]([O-])=O)c1nc2c3c(C)c(C)sc3ncn2n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4515 |
| logD: | 2.4463 |
| logSw: | -2.2655 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 79.278 |
| InChI Key: | DBXHBSYTVCHDTC-QMMMGPOBSA-N |