N-(2-phenylethyl)-2-[(5-phenyl[1,2,4]triazolo[4,3-c]quinazolin-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2-phenylethyl)-2-[(5-phenyl[1,2,4]triazolo[4,3-c]quinazolin-3-yl)sulfanyl]acetamide
N-(2-phenylethyl)-2-[(5-phenyl[1,2,4]triazolo[4,3-c]quinazolin-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | J084-0086 |
| Compound Name: | N-(2-phenylethyl)-2-[(5-phenyl[1,2,4]triazolo[4,3-c]quinazolin-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 439.54 |
| Molecular Formula: | C25 H21 N5 O S |
| Smiles: | C(CNC(CSc1nnc2c3ccccc3nc(c3ccccc3)n12)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.2112 |
| logD: | 4.2058 |
| logSw: | -4.3369 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.623 |
| InChI Key: | WSADAWVJMOFQEJ-UHFFFAOYSA-N |