N-(2-amino-2-oxo-1-phenylethyl)-2-{[5-(4-methoxyphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2-amino-2-oxo-1-phenylethyl)-2-{[5-(4-methoxyphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetamide
N-(2-amino-2-oxo-1-phenylethyl)-2-{[5-(4-methoxyphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | D692-0186 |
| Compound Name: | N-(2-amino-2-oxo-1-phenylethyl)-2-{[5-(4-methoxyphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 498.56 |
| Molecular Formula: | C26 H22 N6 O3 S |
| Smiles: | COc1ccc(cc1)c1nc2ccccc2c2nnc(n12)SCC(NC(C(N)=O)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0476 |
| logD: | 3.0442 |
| logSw: | -3.3457 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 95.737 |
| InChI Key: | DNNSLGIQPLZWNP-JOCHJYFZSA-N |