2-(2-cyclopropyl-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)-N-[(2,5-difluorophenyl)methyl]acetamide
Chemical Structure Depiction of
2-(2-cyclopropyl-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)-N-[(2,5-difluorophenyl)methyl]acetamide
2-(2-cyclopropyl-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)-N-[(2,5-difluorophenyl)methyl]acetamide
Compound characteristics
| Compound ID: | S529-0344 |
| Compound Name: | 2-(2-cyclopropyl-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)-N-[(2,5-difluorophenyl)methyl]acetamide |
| Molecular Weight: | 386.4 |
| Molecular Formula: | C20 H20 F2 N4 O2 |
| Smiles: | C1Cc2c(cnc(C3CC3)n2)C(N(C1)CC(NCc1cc(ccc1F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2993 |
| logD: | 2.2992 |
| logSw: | -2.9577 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.233 |
| InChI Key: | JPKNKKVTZQBYAM-UHFFFAOYSA-N |