2-(5-oxo-2-phenyl-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)-N-[2-(pyridin-4-yl)ethyl]acetamide
Chemical Structure Depiction of
2-(5-oxo-2-phenyl-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)-N-[2-(pyridin-4-yl)ethyl]acetamide
2-(5-oxo-2-phenyl-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)-N-[2-(pyridin-4-yl)ethyl]acetamide
Compound characteristics
| Compound ID: | S529-0586 |
| Compound Name: | 2-(5-oxo-2-phenyl-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)-N-[2-(pyridin-4-yl)ethyl]acetamide |
| Molecular Weight: | 401.47 |
| Molecular Formula: | C23 H23 N5 O2 |
| Smiles: | C1Cc2c(cnc(c3ccccc3)n2)C(N(C1)CC(NCCc1ccncc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1487 |
| logD: | 1.1038 |
| logSw: | -1.9211 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.98 |
| InChI Key: | OFTYSBJWDRTOKV-UHFFFAOYSA-N |