3-{[(5-bromo-2,4-dimethoxyphenyl)methylidene]amino}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-{[(5-bromo-2,4-dimethoxyphenyl)methylidene]amino}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
3-{[(5-bromo-2,4-dimethoxyphenyl)methylidene]amino}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 4215-0127 |
| Compound Name: | 3-{[(5-bromo-2,4-dimethoxyphenyl)methylidene]amino}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 448.34 |
| Molecular Formula: | C19 H18 Br N3 O3 S |
| Smiles: | COc1cc(c(cc1/C=N/N1C=Nc2c(C1=O)c1CCCCc1s2)[Br])OC |
| Stereo: | ACHIRAL |
| logP: | 4.249 |
| logD: | 4.2471 |
| logSw: | -4.4369 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.298 |
| InChI Key: | ODLORVASSXJCIJ-UHFFFAOYSA-N |