3-{[(3,5-dichloro-2-methoxyphenyl)methylidene]amino}-2-(2-methylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-{[(3,5-dichloro-2-methoxyphenyl)methylidene]amino}-2-(2-methylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
3-{[(3,5-dichloro-2-methoxyphenyl)methylidene]amino}-2-(2-methylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 8002-6855 |
| Compound Name: | 3-{[(3,5-dichloro-2-methoxyphenyl)methylidene]amino}-2-(2-methylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 498.43 |
| Molecular Formula: | C25 H21 Cl2 N3 O2 S |
| Smiles: | Cc1ccccc1C1=Nc2c(C(N1/N=C/c1cc(cc(c1OC)[Cl])[Cl])=O)c1CCCCc1s2 |
| Stereo: | ACHIRAL |
| logP: | 6.6394 |
| logD: | 6.6394 |
| logSw: | -6.2195 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.305 |
| InChI Key: | CVRMRQJPIUNAHJ-UHFFFAOYSA-N |