866051-02-7
Product Name:
4-[(4-CHLOROPHENYL)SULFONYL]-6-(ETHYLSULFONYL)-3,4-DIHYDRO-2H-1,4-BENZOXAZINE-2-CARBOXYLIC ACID
Formula:
C17H16ClNO7S2
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COMPUTED DESCRIPTORS
Molecular Weight | 445.9 g/mol |
---|---|
XLogP3 | 2.2 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 8 |
Rotatable Bond Count | 5 |
Exact Mass | 445.0056719 g/mol |
Monoisotopic Mass | 445.0056719 g/mol |
Topological Polar Surface Area | 135 Ų |
Heavy Atom Count | 28 |
Formal Charge | 0 |
Complexity | 781 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |