2-(2-cyclopropyl-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)-N-(4-methylphenyl)acetamide
Chemical Structure Depiction of
2-(2-cyclopropyl-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)-N-(4-methylphenyl)acetamide
2-(2-cyclopropyl-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)-N-(4-methylphenyl)acetamide
Compound characteristics
| Compound ID: | S529-0291 |
| Compound Name: | 2-(2-cyclopropyl-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)-N-(4-methylphenyl)acetamide |
| Molecular Weight: | 350.42 |
| Molecular Formula: | C20 H22 N4 O2 |
| Smiles: | Cc1ccc(cc1)NC(CN1CCCc2c(cnc(C3CC3)n2)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5638 |
| logD: | 2.5637 |
| logSw: | -2.9555 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.911 |
| InChI Key: | PQRSPUFWBMKWRP-UHFFFAOYSA-N |