2-(5-{[(3-bromophenyl)methyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)thieno[2,3-b]pyridin-3-amine
Chemical Structure Depiction of
2-(5-{[(3-bromophenyl)methyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)thieno[2,3-b]pyridin-3-amine
2-(5-{[(3-bromophenyl)methyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)thieno[2,3-b]pyridin-3-amine
Compound characteristics
| Compound ID: | D549-0065 |
| Compound Name: | 2-(5-{[(3-bromophenyl)methyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)thieno[2,3-b]pyridin-3-amine |
| Molecular Weight: | 432.36 |
| Molecular Formula: | C17 H14 Br N5 S2 |
| Smiles: | Cn1c(c2c(c3cccnc3s2)N)nnc1SCc1cccc(c1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.9686 |
| logD: | 3.967 |
| logSw: | -4.2436 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.59 |
| InChI Key: | UNTDJZOPGXSHIU-UHFFFAOYSA-N |