2-methyl-N-(4-nitrophenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-amine
Chemical Structure Depiction of
2-methyl-N-(4-nitrophenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-amine
2-methyl-N-(4-nitrophenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-amine
Compound characteristics
| Compound ID: | K696-0091 |
| Compound Name: | 2-methyl-N-(4-nitrophenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-amine |
| Molecular Weight: | 340.4 |
| Molecular Formula: | C17 H16 N4 O2 S |
| Smiles: | Cc1nc(c2c3CCCCc3sc2n1)Nc1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.8747 |
| logD: | 4.8549 |
| logSw: | -4.8407 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.381 |
| InChI Key: | MDONDUASKALKRN-UHFFFAOYSA-N |