2-(5-oxo-2-phenyl-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)-N-[3-(1H-pyrazol-1-yl)propyl]acetamide
Chemical Structure Depiction of
2-(5-oxo-2-phenyl-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)-N-[3-(1H-pyrazol-1-yl)propyl]acetamide
2-(5-oxo-2-phenyl-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)-N-[3-(1H-pyrazol-1-yl)propyl]acetamide
Compound characteristics
| Compound ID: | S529-0633 |
| Compound Name: | 2-(5-oxo-2-phenyl-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)-N-[3-(1H-pyrazol-1-yl)propyl]acetamide |
| Molecular Weight: | 404.47 |
| Molecular Formula: | C22 H24 N6 O2 |
| Smiles: | C1Cc2c(cnc(c3ccccc3)n2)C(N(C1)CC(NCCCn1cccn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9272 |
| logD: | 0.9271 |
| logSw: | -2.1968 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.325 |
| InChI Key: | DGERXPXLMPJXBN-UHFFFAOYSA-N |