293762-52-4
Product Name:
2-(4-ACETOXY-PHENYL)-BENZOTHIAZOLE-6-CARBOXYLIC ACID
Formula:
C16H11NO4S
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 313.3 g/mol |
---|---|
XLogP3 | 3.5 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 4 |
Exact Mass | 313.04087901 g/mol |
Monoisotopic Mass | 313.04087901 g/mol |
Topological Polar Surface Area | 105 Ų |
Heavy Atom Count | 22 |
Formal Charge | 0 |
Complexity | 436 |
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 |