4-{2-[(3-nitrophenyl)methylidene]hydrazinyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Chemical Structure Depiction of
4-{2-[(3-nitrophenyl)methylidene]hydrazinyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
4-{2-[(3-nitrophenyl)methylidene]hydrazinyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Compound characteristics
| Compound ID: | 0787-0576 |
| Compound Name: | 4-{2-[(3-nitrophenyl)methylidene]hydrazinyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine |
| Molecular Weight: | 353.4 |
| Molecular Formula: | C17 H15 N5 O2 S |
| Smiles: | C1CCc2c(C1)c1c(N/N=C/c3cccc(c3)[N+]([O-])=O)ncnc1s2 |
| Stereo: | ACHIRAL |
| logP: | 4.6436 |
| logD: | 4.6434 |
| logSw: | -4.9889 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.232 |
| InChI Key: | STZMEAFXWDJBIT-UHFFFAOYSA-N |