3-(2-acetamido-1,3-benzothiazol-6-yl)-N-[(2-chloro-4-fluorophenyl)methyl]propanamide
Chemical Structure Depiction of
3-(2-acetamido-1,3-benzothiazol-6-yl)-N-[(2-chloro-4-fluorophenyl)methyl]propanamide
3-(2-acetamido-1,3-benzothiazol-6-yl)-N-[(2-chloro-4-fluorophenyl)methyl]propanamide
Compound characteristics
Compound ID: | F222-0553 |
Compound Name: | 3-(2-acetamido-1,3-benzothiazol-6-yl)-N-[(2-chloro-4-fluorophenyl)methyl]propanamide |
Molecular Weight: | 405.88 |
Molecular Formula: | C19 H17 Cl F N3 O2 S |
Smiles: | CC(Nc1nc2ccc(CCC(NCc3ccc(cc3[Cl])F)=O)cc2s1)=O |
Stereo: | ACHIRAL |
logP: | 4.2544 |
logD: | 4.2544 |
logSw: | -4.4467 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 57.462 |
InChI Key: | ITKIDIBXQAQZIL-UHFFFAOYSA-N |