2-{[5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(7-methyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)acetamide
Chemical Structure Depiction of
2-{[5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(7-methyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)acetamide
2-{[5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(7-methyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)acetamide
Compound characteristics
| Compound ID: | Y020-2458 |
| Compound Name: | 2-{[5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(7-methyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)acetamide |
| Molecular Weight: | 424.48 |
| Molecular Formula: | C20 H20 N6 O3 S |
| Smiles: | CC1CC(c2cnc(NC(CSc3nnc(c4ccccc4OC)[nH]3)=O)nc2C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8467 |
| logD: | 0.7946 |
| logSw: | -2.5781 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 98.15 |
| InChI Key: | FGHOOMKUUXZOKE-LLVKDONJSA-N |