N,N'-(pyridine-2,6-diyl)bis{2-[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide}
Chemical Structure Depiction of
N,N'-(pyridine-2,6-diyl)bis{2-[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide}
N,N'-(pyridine-2,6-diyl)bis{2-[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide}
Compound characteristics
| Compound ID: | 8007-4270 |
| Compound Name: | N,N'-(pyridine-2,6-diyl)bis{2-[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide} |
| Molecular Weight: | 649.76 |
| Molecular Formula: | C31 H27 N11 O2 S2 |
| Smiles: | CCn1c2ccccc2c2c1nc(nn2)SCC(Nc1cccc(NC(CSc2nc3c(c4ccccc4n3CC)nn2)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1908 |
| logD: | 5.1908 |
| logSw: | -5.2322 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 121.216 |
| InChI Key: | CFLLDTFXTWRHJD-UHFFFAOYSA-N |