N-(5-methyl-1,2-oxazol-3-yl)-2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide
Chemical Structure Depiction of
N-(5-methyl-1,2-oxazol-3-yl)-2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide
N-(5-methyl-1,2-oxazol-3-yl)-2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide
Compound characteristics
| Compound ID: | 4499-0028 |
| Compound Name: | N-(5-methyl-1,2-oxazol-3-yl)-2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide |
| Molecular Weight: | 410.5 |
| Molecular Formula: | C20 H22 N6 O2 S |
| Smiles: | CCCn1c2ccccc2c2c1nc(nn2)SC(CC)C(Nc1cc(C)on1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6269 |
| logD: | 4.5761 |
| logSw: | -4.2809 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.115 |
| InChI Key: | HBHJIIBJGNCVLM-HNNXBMFYSA-N |