3-bromo-N-[4-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)phenyl]benzamide
Chemical Structure Depiction of
3-bromo-N-[4-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)phenyl]benzamide
3-bromo-N-[4-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)phenyl]benzamide
Compound characteristics
Compound ID: | 6865-4112 |
Compound Name: | 3-bromo-N-[4-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)phenyl]benzamide |
Molecular Weight: | 458.32 |
Molecular Formula: | C23 H16 Br N5 O |
Smiles: | Cc1c2ccccc2c2nnc(c3ccc(cc3)NC(c3cccc(c3)[Br])=O)n2n1 |
Stereo: | ACHIRAL |
logP: | 4.8297 |
logD: | 4.8294 |
logSw: | -4.8768 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 56.34 |
InChI Key: | ZTZVNDYDIOFNJM-UHFFFAOYSA-N |