2-[(1,3-benzoxazol-2-yl)sulfanyl]-N-(4-chloro-2-nitrophenyl)acetamide
Chemical Structure Depiction of
2-[(1,3-benzoxazol-2-yl)sulfanyl]-N-(4-chloro-2-nitrophenyl)acetamide
2-[(1,3-benzoxazol-2-yl)sulfanyl]-N-(4-chloro-2-nitrophenyl)acetamide
Compound characteristics
Compound ID: | 8008-4841 |
Compound Name: | 2-[(1,3-benzoxazol-2-yl)sulfanyl]-N-(4-chloro-2-nitrophenyl)acetamide |
Molecular Weight: | 363.78 |
Molecular Formula: | C15 H10 Cl N3 O4 S |
Smiles: | C(C(Nc1ccc(cc1[N+]([O-])=O)[Cl])=O)Sc1nc2ccccc2o1 |
Stereo: | ACHIRAL |
logP: | 4.0784 |
logD: | 3.6504 |
logSw: | -4.4953 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.162 |
InChI Key: | YYWMAZSSASQKCM-UHFFFAOYSA-N |