N-(5-phenyl-6H-1,3,4-thiadiazin-2-yl)-2-{[5-(prop-2-en-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(5-phenyl-6H-1,3,4-thiadiazin-2-yl)-2-{[5-(prop-2-en-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}acetamide
N-(5-phenyl-6H-1,3,4-thiadiazin-2-yl)-2-{[5-(prop-2-en-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | D041-0014 |
| Compound Name: | N-(5-phenyl-6H-1,3,4-thiadiazin-2-yl)-2-{[5-(prop-2-en-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 473.58 |
| Molecular Formula: | C23 H19 N7 O S2 |
| Smiles: | C=CCn1c2ccccc2c2c1nc(nn2)SCC(NC1=NN=C(CS1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3016 |
| logD: | 4.3006 |
| logSw: | -4.3583 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.789 |
| InChI Key: | SXJYPEDEIJPZFP-UHFFFAOYSA-N |