N-(2-chloro-4-fluorophenyl)-4-oxo-4-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)-1,4-diazepan-1-yl]butanamide
Chemical Structure Depiction of
N-(2-chloro-4-fluorophenyl)-4-oxo-4-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)-1,4-diazepan-1-yl]butanamide
N-(2-chloro-4-fluorophenyl)-4-oxo-4-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)-1,4-diazepan-1-yl]butanamide
Compound characteristics
| Compound ID: | L461-0461 |
| Compound Name: | N-(2-chloro-4-fluorophenyl)-4-oxo-4-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)-1,4-diazepan-1-yl]butanamide |
| Molecular Weight: | 461.94 |
| Molecular Formula: | C21 H21 Cl F N5 O2 S |
| Smiles: | C1CN(CCN(C1)c1nc2cccnc2s1)C(CCC(Nc1ccc(cc1[Cl])F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8992 |
| logD: | 2.8773 |
| logSw: | -3.4342 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.343 |
| InChI Key: | OFMMYYZEPHASCP-UHFFFAOYSA-N |