N-{2,2,2-trichloro-1-[(pyrimidin-2-yl)sulfanyl]ethyl}benzamide
Chemical Structure Depiction of
N-{2,2,2-trichloro-1-[(pyrimidin-2-yl)sulfanyl]ethyl}benzamide
N-{2,2,2-trichloro-1-[(pyrimidin-2-yl)sulfanyl]ethyl}benzamide
Compound characteristics
Compound ID: | 1491-0695 |
Compound Name: | N-{2,2,2-trichloro-1-[(pyrimidin-2-yl)sulfanyl]ethyl}benzamide |
Molecular Weight: | 362.66 |
Molecular Formula: | C13 H10 Cl3 N3 O S |
Smiles: | c1ccc(cc1)C(NC(C([Cl])([Cl])[Cl])Sc1ncccn1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.2907 |
logD: | 3.1876 |
logSw: | -3.7871 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 41.714 |
InChI Key: | FTFXTRXYVRTTJJ-NSHDSACASA-N |