4-(adamantan-1-yl)-N-(3-methyl-1-oxo-1-{[(pyridin-3-yl)methyl]amino}butan-2-yl)benzamide
Chemical Structure Depiction of
4-(adamantan-1-yl)-N-(3-methyl-1-oxo-1-{[(pyridin-3-yl)methyl]amino}butan-2-yl)benzamide
4-(adamantan-1-yl)-N-(3-methyl-1-oxo-1-{[(pyridin-3-yl)methyl]amino}butan-2-yl)benzamide
Compound characteristics
| Compound ID: | C155-0456 |
| Compound Name: | 4-(adamantan-1-yl)-N-(3-methyl-1-oxo-1-{[(pyridin-3-yl)methyl]amino}butan-2-yl)benzamide |
| Molecular Weight: | 445.61 |
| Molecular Formula: | C28 H35 N3 O2 |
| Smiles: | CC(C)C(C(NCc1cccnc1)=O)NC(c1ccc(cc1)C12CC3CC(CC(C3)C2)C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7538 |
| logD: | 4.7514 |
| logSw: | -4.1739 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.968 |
| InChI Key: | BBYIYPJGMLDLIZ-BTUURDQESA-N |