4-[(4-chlorophenyl)methyl]-2-ethyl-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
Chemical Structure Depiction of
4-[(4-chlorophenyl)methyl]-2-ethyl-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
4-[(4-chlorophenyl)methyl]-2-ethyl-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
Compound characteristics
| Compound ID: | F816-0682 |
| Compound Name: | 4-[(4-chlorophenyl)methyl]-2-ethyl-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione |
| Molecular Weight: | 360.82 |
| Molecular Formula: | C16 H13 Cl N4 O2 S |
| Smiles: | CCN1C(N2C(=N1)N(Cc1ccc(cc1)[Cl])C(c1c2ccs1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4758 |
| logD: | 3.4758 |
| logSw: | -3.7593 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.95 |
| InChI Key: | IUWQWGZKHXOHRO-UHFFFAOYSA-N |