4-oxo-4-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)-1,4-diazepan-1-yl]-N-[4-(trifluoromethoxy)phenyl]butanamide
Chemical Structure Depiction of
4-oxo-4-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)-1,4-diazepan-1-yl]-N-[4-(trifluoromethoxy)phenyl]butanamide
4-oxo-4-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)-1,4-diazepan-1-yl]-N-[4-(trifluoromethoxy)phenyl]butanamide
Compound characteristics
| Compound ID: | L461-0462 |
| Compound Name: | 4-oxo-4-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)-1,4-diazepan-1-yl]-N-[4-(trifluoromethoxy)phenyl]butanamide |
| Molecular Weight: | 493.51 |
| Molecular Formula: | C22 H22 F3 N5 O3 S |
| Smiles: | C1CN(CCN(C1)c1nc2cccnc2s1)C(CCC(Nc1ccc(cc1)OC(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6573 |
| logD: | 3.6535 |
| logSw: | -3.9583 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.978 |
| InChI Key: | NSGRLVYZFAYNTP-UHFFFAOYSA-N |