3-benzyl-7-[4-(5-ethylthiophene-2-sulfonyl)piperazin-1-yl]-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Chemical Structure Depiction of
3-benzyl-7-[4-(5-ethylthiophene-2-sulfonyl)piperazin-1-yl]-3H-[1,2,3]triazolo[4,5-d]pyrimidine
3-benzyl-7-[4-(5-ethylthiophene-2-sulfonyl)piperazin-1-yl]-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Compound characteristics
| Compound ID: | G867-0240 |
| Compound Name: | 3-benzyl-7-[4-(5-ethylthiophene-2-sulfonyl)piperazin-1-yl]-3H-[1,2,3]triazolo[4,5-d]pyrimidine |
| Molecular Weight: | 469.59 |
| Molecular Formula: | C21 H23 N7 O2 S2 |
| Smiles: | CCc1ccc(s1)S(N1CCN(CC1)c1c2c(ncn1)n(Cc1ccccc1)nn2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4387 |
| logD: | 3.4386 |
| logSw: | -3.46 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 83.026 |
| InChI Key: | ILGBAFOCBMGEBN-UHFFFAOYSA-N |