N-[1-(adamantan-1-yl)ethyl]-2-(5-benzyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)acetamide
Chemical Structure Depiction of
N-[1-(adamantan-1-yl)ethyl]-2-(5-benzyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)acetamide
N-[1-(adamantan-1-yl)ethyl]-2-(5-benzyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)acetamide
Compound characteristics
| Compound ID: | C880-0747 |
| Compound Name: | N-[1-(adamantan-1-yl)ethyl]-2-(5-benzyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)acetamide |
| Molecular Weight: | 494.64 |
| Molecular Formula: | C31 H34 N4 O2 |
| Smiles: | CC(C12CC3CC(CC(C3)C2)C1)NC(CN1C(c2c(C=N1)c1ccccc1n2Cc1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3699 |
| logD: | 5.3699 |
| logSw: | -5.7778 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.74 |
| InChI Key: | RWKCTWIHBMCXFP-CGUFXVKMSA-N |