2-(5-oxo-2-phenyl-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
Chemical Structure Depiction of
2-(5-oxo-2-phenyl-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
2-(5-oxo-2-phenyl-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
Compound characteristics
| Compound ID: | S529-0764 |
| Compound Name: | 2-(5-oxo-2-phenyl-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide |
| Molecular Weight: | 426.52 |
| Molecular Formula: | C26 H26 N4 O2 |
| Smiles: | C1CC(c2ccccc2C1)NC(CN1CCCc2c(cnc(c3ccccc3)n2)C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6851 |
| logD: | 3.6851 |
| logSw: | -3.836 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.554 |
| InChI Key: | KYSXYQNWVXQSBE-QFIPXVFZSA-N |