3-[({3-bromo-4-[(4-chlorophenyl)methoxy]-5-ethoxyphenyl}methylidene)amino]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-[({3-bromo-4-[(4-chlorophenyl)methoxy]-5-ethoxyphenyl}methylidene)amino]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
3-[({3-bromo-4-[(4-chlorophenyl)methoxy]-5-ethoxyphenyl}methylidene)amino]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 8008-7796 |
| Compound Name: | 3-[({3-bromo-4-[(4-chlorophenyl)methoxy]-5-ethoxyphenyl}methylidene)amino]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 572.91 |
| Molecular Formula: | C26 H23 Br Cl N3 O3 S |
| Smiles: | CCOc1cc(/C=N/N2C=Nc3c(C2=O)c2CCCCc2s3)cc(c1OCc1ccc(cc1)[Cl])[Br] |
| Stereo: | ACHIRAL |
| logP: | 6.3442 |
| logD: | 6.3351 |
| logSw: | -6.373 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.648 |
| InChI Key: | UUXRJXBXJSOMOH-UHFFFAOYSA-N |