N-(5-chloro-2-methoxyphenyl)-2-[(7-fluoro-5-oxo-4-propyl-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(5-chloro-2-methoxyphenyl)-2-[(7-fluoro-5-oxo-4-propyl-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]acetamide
N-(5-chloro-2-methoxyphenyl)-2-[(7-fluoro-5-oxo-4-propyl-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | F367-0659 |
| Compound Name: | N-(5-chloro-2-methoxyphenyl)-2-[(7-fluoro-5-oxo-4-propyl-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]acetamide |
| Molecular Weight: | 475.93 |
| Molecular Formula: | C21 H19 Cl F N5 O3 S |
| Smiles: | CCCN1C(c2cc(ccc2n2c1nnc2SCC(Nc1cc(ccc1OC)[Cl])=O)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7874 |
| logD: | 3.7845 |
| logSw: | -4.2049 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.644 |
| InChI Key: | MGQRHGZYXAPIRL-UHFFFAOYSA-N |