5-methyl-6-nitrothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
5-methyl-6-nitrothieno[2,3-d]pyrimidin-4(3H)-one
5-methyl-6-nitrothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 8755-0001 |
| Compound Name: | 5-methyl-6-nitrothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 211.2 |
| Molecular Formula: | C7 H5 N3 O3 S |
| Smiles: | Cc1c2C(NC=Nc2sc1[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.3924 |
| logD: | 0.3874 |
| logSw: | -2.0014 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.269 |
| InChI Key: | QKKLPQQKLKIERY-UHFFFAOYSA-N |