105219-71-4
Product Name:
6H-Thieno(3,2-f)(1,2,4)triazolo(4,3-a)(1,4)diazepine-2-propanamide, 4- (2-chlorophenyl)-N-(2-hydroxyethyl)-9-methyl-
Formula:
C20H20ClN5O2S
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COMPUTED DESCRIPTORS
Molecular Weight | 429.9 g/mol |
---|---|
XLogP3 | 0.6 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 6 |
Exact Mass | 429.1026238 g/mol |
Monoisotopic Mass | 429.1026238 g/mol |
Topological Polar Surface Area | 121 Ų |
Heavy Atom Count | 29 |
Formal Charge | 0 |
Complexity | 624 |
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 |