N-(3-chloro-4-methoxyphenyl)-2-{[5-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-2-{[5-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetamide
N-(3-chloro-4-methoxyphenyl)-2-{[5-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | D692-0585 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-2-{[5-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 465.92 |
| Molecular Formula: | C22 H16 Cl N5 O3 S |
| Smiles: | COc1ccc(cc1[Cl])NC(CSc1nnc2c3ccccc3nc(c3ccco3)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3203 |
| logD: | 4.32 |
| logSw: | -4.4979 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.668 |
| InChI Key: | YXNJSGOPAIDMOL-UHFFFAOYSA-N |