N-(2-methoxyethyl)-2-{[5-(4-methoxyphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2-methoxyethyl)-2-{[5-(4-methoxyphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetamide
N-(2-methoxyethyl)-2-{[5-(4-methoxyphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | D692-0129 |
| Compound Name: | N-(2-methoxyethyl)-2-{[5-(4-methoxyphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 423.49 |
| Molecular Formula: | C21 H21 N5 O3 S |
| Smiles: | COCCNC(CSc1nnc2c3ccccc3nc(c3ccc(cc3)OC)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8579 |
| logD: | 2.8546 |
| logSw: | -3.2133 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.781 |
| InChI Key: | OESWVLBMEBFLCQ-UHFFFAOYSA-N |