354557-58-7
Product Name:
3-(3,4-DIMETHYL-6-OXO-6H-PYRANO[2,3-C]PYRAZOL-1-YL)-BENZOIC ACID
Formula:
C15H12N2O4
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 284.27 g/mol |
---|---|
XLogP3 | 2.1 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 2 |
Exact Mass | 284.07970687 g/mol |
Monoisotopic Mass | 284.07970687 g/mol |
Topological Polar Surface Area | 81.4 Ų |
Heavy Atom Count | 21 |
Formal Charge | 0 |
Complexity | 490 |
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 |