2-[(7-fluoro-5-oxo-4-propyl-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]-N-(3-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-[(7-fluoro-5-oxo-4-propyl-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]-N-(3-methoxyphenyl)acetamide
2-[(7-fluoro-5-oxo-4-propyl-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]-N-(3-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | F367-0645 |
| Compound Name: | 2-[(7-fluoro-5-oxo-4-propyl-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]-N-(3-methoxyphenyl)acetamide |
| Molecular Weight: | 441.48 |
| Molecular Formula: | C21 H20 F N5 O3 S |
| Smiles: | CCCN1C(c2cc(ccc2n2c1nnc2SCC(Nc1cccc(c1)OC)=O)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.601 |
| logD: | 3.601 |
| logSw: | -3.8132 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.255 |
| InChI Key: | TZXIOVSXPLGVAV-UHFFFAOYSA-N |