2-[(8-bromo-5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N,N-diphenylacetamide
Chemical Structure Depiction of
2-[(8-bromo-5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N,N-diphenylacetamide
2-[(8-bromo-5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N,N-diphenylacetamide
Compound characteristics
Compound ID: | 8009-9747 |
Compound Name: | 2-[(8-bromo-5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N,N-diphenylacetamide |
Molecular Weight: | 504.41 |
Molecular Formula: | C24 H18 Br N5 O S |
Smiles: | Cn1c2ccc(cc2c2c1nc(nn2)SCC(N(c1ccccc1)c1ccccc1)=O)[Br] |
Stereo: | ACHIRAL |
logP: | 4.7973 |
logD: | 4.7973 |
logSw: | -4.7026 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 48.403 |
InChI Key: | WNQWRICXWBKTGC-UHFFFAOYSA-N |