8-bromo-3-(4-methoxyphenyl)-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
Chemical Structure Depiction of
8-bromo-3-(4-methoxyphenyl)-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
8-bromo-3-(4-methoxyphenyl)-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
Compound characteristics
Compound ID: | D148-0103 |
Compound Name: | 8-bromo-3-(4-methoxyphenyl)-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one |
Molecular Weight: | 417.28 |
Molecular Formula: | C17 H13 Br N4 O2 S |
Smiles: | Cc1c(c(C)nc2c1c1c(C(N(c3ccc(cc3)OC)N=N1)=O)s2)[Br] |
Stereo: | ACHIRAL |
logP: | 4.7132 |
logD: | 4.7132 |
logSw: | -4.7957 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 55.103 |
InChI Key: | OGTXEPUILQTIPM-UHFFFAOYSA-N |