2-[(1,3-benzoxazol-2-yl)sulfanyl]-N-[3-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)phenyl]acetamide
Chemical Structure Depiction of
2-[(1,3-benzoxazol-2-yl)sulfanyl]-N-[3-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)phenyl]acetamide
2-[(1,3-benzoxazol-2-yl)sulfanyl]-N-[3-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)phenyl]acetamide
Compound characteristics
| Compound ID: | 6725-3996 |
| Compound Name: | 2-[(1,3-benzoxazol-2-yl)sulfanyl]-N-[3-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)phenyl]acetamide |
| Molecular Weight: | 466.52 |
| Molecular Formula: | C25 H18 N6 O2 S |
| Smiles: | Cc1c2ccccc2c2nnc(c3cccc(c3)NC(CSc3nc4ccccc4o3)=O)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 4.9242 |
| logD: | 4.9241 |
| logSw: | -4.8819 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.79 |
| InChI Key: | OLXUQWZCDHHQQV-UHFFFAOYSA-N |