N-(naphthalen-1-yl)-2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide
Chemical Structure Depiction of
N-(naphthalen-1-yl)-2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide
N-(naphthalen-1-yl)-2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide
Compound characteristics
| Compound ID: | 8008-7045 |
| Compound Name: | N-(naphthalen-1-yl)-2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide |
| Molecular Weight: | 455.58 |
| Molecular Formula: | C26 H25 N5 O S |
| Smiles: | CCCn1c2ccccc2c2c1nc(nn2)SC(CC)C(Nc1cccc2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.986 |
| logD: | 5.986 |
| logSw: | -6.5844 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.35 |
| InChI Key: | IJHKWUGZVFFIJB-QFIPXVFZSA-N |