3-(3,4-dichlorophenyl)-1-[(2,4,6-trimethylphenyl)methyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-(3,4-dichlorophenyl)-1-[(2,4,6-trimethylphenyl)methyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
3-(3,4-dichlorophenyl)-1-[(2,4,6-trimethylphenyl)methyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C258-0699 |
| Compound Name: | 3-(3,4-dichlorophenyl)-1-[(2,4,6-trimethylphenyl)methyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 499.46 |
| Molecular Formula: | C26 H24 Cl2 N2 O2 S |
| Smiles: | Cc1cc(C)c(CN2C(N(C(c3c4CCCCc4sc23)=O)c2ccc(c(c2)[Cl])[Cl])=O)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 7.813 |
| logD: | 7.813 |
| logSw: | -6.8285 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.0276 |
| InChI Key: | XXTUPVDHSQTATI-UHFFFAOYSA-N |