315676-33-6
Product Name:
3-THIOPHENECARBOXYLIC ACID, 2-[(2-CHLOROACETYL)AMINO]-(2-THIENYL)-, ETHYL ESTER
Formula:
C13H12ClNO3S2
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COMPUTED DESCRIPTORS
Molecular Weight | 329.8 g/mol |
---|---|
XLogP3 | 3.8 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 6 |
Exact Mass | 328.9947133 g/mol |
Monoisotopic Mass | 328.9947133 g/mol |
Topological Polar Surface Area | 112 Ų |
Heavy Atom Count | 20 |
Formal Charge | 0 |
Complexity | 370 |
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 |