6-methyl-3-{2-[1-(3-nitrophenyl)ethylidene]hydrazinyl}-5H-[1,2,4]triazino[5,6-b]indole
Chemical Structure Depiction of
6-methyl-3-{2-[1-(3-nitrophenyl)ethylidene]hydrazinyl}-5H-[1,2,4]triazino[5,6-b]indole
6-methyl-3-{2-[1-(3-nitrophenyl)ethylidene]hydrazinyl}-5H-[1,2,4]triazino[5,6-b]indole
Compound characteristics
Compound ID: | 1927-7908 |
Compound Name: | 6-methyl-3-{2-[1-(3-nitrophenyl)ethylidene]hydrazinyl}-5H-[1,2,4]triazino[5,6-b]indole |
Molecular Weight: | 361.36 |
Molecular Formula: | C18 H15 N7 O2 |
Smiles: | C/C(c1cccc(c1)[N+]([O-])=O)=N/Nc1nc2c(c3cccc(C)c3[nH]2)nn1 |
Stereo: | ACHIRAL |
logP: | 3.6695 |
logD: | 3.6693 |
logSw: | -4.1522 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 98.795 |
InChI Key: | CCUQSSWAPAPPHU-UHFFFAOYSA-N |