2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-1-(morpholin-4-yl)ethan-1-one
Chemical Structure Depiction of
2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-1-(morpholin-4-yl)ethan-1-one
2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-1-(morpholin-4-yl)ethan-1-one
Compound characteristics
| Compound ID: | 8012-0639 |
| Compound Name: | 2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-1-(morpholin-4-yl)ethan-1-one |
| Molecular Weight: | 343.41 |
| Molecular Formula: | C16 H17 N5 O2 S |
| Smiles: | Cn1c2ccccc2c2c1nc(nn2)SCC(N1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1056 |
| logD: | 1.1056 |
| logSw: | -2.1278 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.089 |
| InChI Key: | TYCZZHHMLXJFOQ-UHFFFAOYSA-N |