N-(4-acetamidophenyl)-2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(4-acetamidophenyl)-2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide
N-(4-acetamidophenyl)-2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide
Compound characteristics
Compound ID: | 5471-0109 |
Compound Name: | N-(4-acetamidophenyl)-2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide |
Molecular Weight: | 406.46 |
Molecular Formula: | C20 H18 N6 O2 S |
Smiles: | CC(Nc1ccc(cc1)NC(CSc1nc2c(c3ccccc3n2C)nn1)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.2026 |
logD: | 2.2026 |
logSw: | -2.6443 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 80.2 |
InChI Key: | DWPHSBZWOSZOOP-UHFFFAOYSA-N |