41503-61-1
Product Name:
3-ETHYL-2-(2-[(3-ETHYL-5-PHENYL-2(3H)-BENZOXAZOLINYLIDENE) METHYL]-1-BUTENYL )-5-PHENYL BENZOXAZOLIUM ETHYL SULFATE
Formula:
C37H38N2O6S
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COMPUTED DESCRIPTORS
Molecular Weight | 638.8 g/mol |
---|---|
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 7 |
Rotatable Bond Count | 8 |
Exact Mass | 638.24505811 g/mol |
Monoisotopic Mass | 638.24505811 g/mol |
Topological Polar Surface Area | 104 Ų |
Heavy Atom Count | 46 |
Formal Charge | 0 |
Complexity | 894 |
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 | 2 |
Compound Is Canonicalized | Yes |