94771-99-0
Product Name:
2H-Tetrazole-2-acetic acid, 5-(3,4-dimethoxyphenyl)-, 2-(((4-chlorophe nyl)amino)thioxomethyl)hydrazide
Formula:
C18H18ClN7O3S
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 447.9 g/mol |
---|---|
XLogP3 | 3.3 |
Hydrogen Bond Donor Count | 3 |
Hydrogen Bond Acceptor Count | 7 |
Rotatable Bond Count | 6 |
Exact Mass | 447.0880363 g/mol |
Monoisotopic Mass | 447.0880363 g/mol |
Topological Polar Surface Area | 147 Ų |
Heavy Atom Count | 30 |
Formal Charge | 0 |
Complexity | 582 |
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 |