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Home > Fluorides > 147695-92-9
147695-92-9 | Propanamide, 3,3,3-trifluoro-2-hydroxy-2-methyl-N-[4-(phenylsulfonyl)phenyl]-
CAS No: 147695-92-9 Catalog No: AG001F36 MDL No:
Product Description
Catalog Number:
AG001F36
Chemical Name:
Propanamide, 3,3,3-trifluoro-2-hydroxy-2-methyl-N-[4-(phenylsulfonyl)phenyl]-
CAS Number:
147695-92-9
Molecular Formula:
C16H14F3NO4S
Molecular Weight:
373.3469
IUPAC Name:
N-[4-(benzenesulfonyl)phenyl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide
InChI:
InChI=1S/C16H14F3NO4S/c1-15(22,16(17,18)19)14(21)20-11-7-9-13(10-8-11)25(23,24)12-5-3-2-4-6-12/h2-10,22H,1H3,(H,20,21)
InChI Key:
LJLXQHHFAKVTNP-UHFFFAOYSA-N
SMILES:
O=C(C(C(F)(F)F)(O)C)Nc1ccc(cc1)S(=O)(=O)c1ccccc1
Properties
Complexity:
573
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
373.06g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
373.346g/mol
Monoisotopic Mass:
373.06g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Literature
| Title | Journal |
|---|---|
| Inhibitory effects of different ATP-sensitive potassium channel openers on electrically generated and carbachol-induced contractions of porcine and human detrusor muscle. | Fundamental & clinical pharmacology 20080201 |
| Effect of the ATP-sensitive potassium channel opener ZM226600 on cystometric parameters in rats with ligature-intact, partial urethral obstruction. | European journal of pharmacology 20050523 |
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