63244-05-3
Product Name:
METHYL 3-(4-CHLOROPHENYL)-4-CYANO-5-(METHYLTHIO)THIOPHENE-2-CARBOXYLATE
Formula:
C14H10ClNO2S2
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COMPUTED DESCRIPTORS
Molecular Weight | 323.8 g/mol |
---|---|
XLogP3 | 4.6 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 4 |
Exact Mass | 322.9841486 g/mol |
Monoisotopic Mass | 322.9841486 g/mol |
Topological Polar Surface Area | 104 Ų |
Heavy Atom Count | 20 |
Formal Charge | 0 |
Complexity | 403 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |