4-[3-(5-chloro-2-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-phenylquinoline
Chemical Structure Depiction of
4-[3-(5-chloro-2-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-phenylquinoline
4-[3-(5-chloro-2-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-phenylquinoline
Compound characteristics
Compound ID: | 8019-6339 |
Compound Name: | 4-[3-(5-chloro-2-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-phenylquinoline |
Molecular Weight: | 469.95 |
Molecular Formula: | C25 H16 Cl N5 O S |
Smiles: | COc1ccc(cc1c1nnc2n1nc(c1cc(c3ccccc3)nc3ccccc13)s2)[Cl] |
Stereo: | ACHIRAL |
logP: | 6.3591 |
logD: | 6.3559 |
logSw: | -6.4018 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 49.411 |
InChI Key: | NUTVNJNSPDSZAG-UHFFFAOYSA-N |