1-[(2,5-dimethylphenyl)methyl]-3-(2-phenylethyl)[1]benzothieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
1-[(2,5-dimethylphenyl)methyl]-3-(2-phenylethyl)[1]benzothieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
1-[(2,5-dimethylphenyl)methyl]-3-(2-phenylethyl)[1]benzothieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C688-1055 |
| Compound Name: | 1-[(2,5-dimethylphenyl)methyl]-3-(2-phenylethyl)[1]benzothieno[3,2-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 440.56 |
| Molecular Formula: | C27 H24 N2 O2 S |
| Smiles: | Cc1ccc(C)c(CN2C(N(CCc3ccccc3)C(c3c2c2ccccc2s3)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.999 |
| logD: | 6.999 |
| logSw: | -5.8056 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.149 |
| InChI Key: | YMILQLADDIPKRK-UHFFFAOYSA-N |