2-[(3-bromophenyl)methyl]-4-methyl-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
Chemical Structure Depiction of
2-[(3-bromophenyl)methyl]-4-methyl-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
2-[(3-bromophenyl)methyl]-4-methyl-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
Compound characteristics
| Compound ID: | F816-0015 |
| Compound Name: | 2-[(3-bromophenyl)methyl]-4-methyl-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione |
| Molecular Weight: | 391.24 |
| Molecular Formula: | C15 H11 Br N4 O2 S |
| Smiles: | CN1C2=NN(Cc3cccc(c3)[Br])C(N2c2ccsc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9202 |
| logD: | 2.9202 |
| logSw: | -3.3246 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.991 |
| InChI Key: | KQBQQEFLSSJZLV-UHFFFAOYSA-N |