321574-10-1
Product Name:
METHYL 3-(([1-(4-CHLOROBENZOYL)-3-METHYL-1H-PYRAZOL-4-YL]CARBONYL)AMINO)-2-THIOPHENECARBOXYLATE
Formula:
C18H14ClN3O4S
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COMPUTED DESCRIPTORS
Molecular Weight | 403.8 g/mol |
---|---|
XLogP3 | 4.1 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 5 |
Exact Mass | 403.0393548 g/mol |
Monoisotopic Mass | 403.0393548 g/mol |
Topological Polar Surface Area | 119 Ų |
Heavy Atom Count | 27 |
Formal Charge | 0 |
Complexity | 585 |
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 |