N-[1-(adamantan-1-yl)ethyl]-2-(9-methoxy-4-methyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-[1-(adamantan-1-yl)ethyl]-2-(9-methoxy-4-methyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
N-[1-(adamantan-1-yl)ethyl]-2-(9-methoxy-4-methyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | C786-2521 |
| Compound Name: | N-[1-(adamantan-1-yl)ethyl]-2-(9-methoxy-4-methyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide |
| Molecular Weight: | 448.56 |
| Molecular Formula: | C26 H32 N4 O3 |
| Smiles: | CC(C12CC3CC(CC(C3)C2)C1)NC(CN1C(c2cc3c(cccc3n2C(C)=N1)OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.15 |
| logD: | 4.15 |
| logSw: | -4.3891 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.674 |
| InChI Key: | UPDUVGKZPJQFFD-OPEHLFBYSA-N |