4-{2-[(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-N-(2-bromo-4-methylphenyl)-6-(morpholin-4-yl)-1,3,5-triazin-2-amine--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-{2-[(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-N-(2-bromo-4-methylphenyl)-6-(morpholin-4-yl)-1,3,5-triazin-2-amine--hydrogen chloride (1/1)
4-{2-[(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-N-(2-bromo-4-methylphenyl)-6-(morpholin-4-yl)-1,3,5-triazin-2-amine--hydrogen chloride (1/1)
Compound characteristics
Compound ID: | 8008-5324 |
Compound Name: | 4-{2-[(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-N-(2-bromo-4-methylphenyl)-6-(morpholin-4-yl)-1,3,5-triazin-2-amine--hydrogen chloride (1/1) |
Molecular Weight: | 548.83 |
Molecular Formula: | C22 H22 Br N7 O3 |
Salt: | HCl |
Smiles: | Cc1ccc(c(c1)[Br])Nc1nc(N/N=C/c2ccc3c(c2)OCO3)nc(n1)N1CCOCC1 |
Stereo: | ACHIRAL |
logP: | 5.9486 |
logD: | 5.9475 |
logSw: | -5.6081 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 89.128 |
InChI Key: | AYSNYSIKBAMSMA-WYMPLXKRSA-N |