1192655-41-6
Product Name:
4-(4-CHLOROPHENYL)-2,6-DIOXOCYCLOHEXANECARBALDEHYDE O-[(5-CHLORO-1,2,3-THIADIAZOL-4-YL)METHYL]OXIME
Formula:
C16H13Cl2N3O3S
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COMPUTED DESCRIPTORS
Molecular Weight | 398.3 g/mol |
---|---|
XLogP3 | 3.5 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 7 |
Rotatable Bond Count | 5 |
Exact Mass | 397.0054678 g/mol |
Monoisotopic Mass | 397.0054678 g/mol |
Topological Polar Surface Area | 113 Ų |
Heavy Atom Count | 25 |
Formal Charge | 0 |
Complexity | 553 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 1 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |