339026-38-9
Product Name:
2-[2-(4-CHLOROANILINO)VINYL]-4-(TRIFLUOROMETHYL)-1,3-THIAZOLE-5-CARBONITRILE
Formula:
C13H7ClF3N3S
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COMPUTED DESCRIPTORS
Molecular Weight | 329.73 g/mol |
---|---|
XLogP3 | 4.6 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 7 |
Rotatable Bond Count | 3 |
Exact Mass | 329.0001306 g/mol |
Monoisotopic Mass | 329.0001306 g/mol |
Topological Polar Surface Area | 77 Ų |
Heavy Atom Count | 21 |
Formal Charge | 0 |
Complexity | 426 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 1 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |