406465-62-1
Product Name:
2-[[4-(4-methoxyphenyl)-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-[(E)-3-(2-methoxyphenyl)prop-2-enylidene]amino]acetamide
Formula:
C28H27N5O3S
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 513.6 g/mol |
---|---|
XLogP3 | 5.3 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 7 |
Rotatable Bond Count | 10 |
Exact Mass | 513.18346091 g/mol |
Monoisotopic Mass | 513.18346091 g/mol |
Topological Polar Surface Area | 116 Ų |
Heavy Atom Count | 37 |
Formal Charge | 0 |
Complexity | 752 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 2 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |