4-benzyl-2-[(2-methylphenyl)methyl]-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
Chemical Structure Depiction of
4-benzyl-2-[(2-methylphenyl)methyl]-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
4-benzyl-2-[(2-methylphenyl)methyl]-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
Compound characteristics
| Compound ID: | F816-0139 |
| Compound Name: | 4-benzyl-2-[(2-methylphenyl)methyl]-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione |
| Molecular Weight: | 402.47 |
| Molecular Formula: | C22 H18 N4 O2 S |
| Smiles: | Cc1ccccc1CN1C(N2C(=N1)N(Cc1ccccc1)C(c1c2ccs1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7965 |
| logD: | 4.7965 |
| logSw: | -4.5316 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.954 |
| InChI Key: | JBBLNUBJAQMJGZ-UHFFFAOYSA-N |