N-tert-butyl-4-{3-[(4-fluorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide
Chemical Structure Depiction of
N-tert-butyl-4-{3-[(4-fluorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide
N-tert-butyl-4-{3-[(4-fluorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide
Compound characteristics
| Compound ID: | J076-0581 |
| Compound Name: | N-tert-butyl-4-{3-[(4-fluorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide |
| Molecular Weight: | 383.46 |
| Molecular Formula: | C22 H26 F N3 O2 |
| Smiles: | CC(C)(C)NC(c1ccc(cc1)N1CCCN(Cc2ccc(cc2)F)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7158 |
| logD: | 3.7158 |
| logSw: | -3.8509 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.306 |
| InChI Key: | IJMRVNGHQVZJES-UHFFFAOYSA-N |