200,000+ products from a single source!
sales@angenechem.com
920269-76-7 | Benzoic acid, 4-[5-methyl-4-(2-propoxyethoxy)-2-thiazolyl]-
CAS No: 920269-76-7 Catalog No: AG006FIB MDL No:
Product Description
Catalog Number:
AG006FIB
Chemical Name:
Benzoic acid, 4-[5-methyl-4-(2-propoxyethoxy)-2-thiazolyl]-
CAS Number:
920269-76-7
Molecular Formula:
C16H19NO4S
Molecular Weight:
321.3914
IUPAC Name:
4-[5-methyl-4-(2-propoxyethoxy)-1,3-thiazol-2-yl]benzoic acid
InChI:
InChI=1S/C16H19NO4S/c1-3-8-20-9-10-21-14-11(2)22-15(17-14)12-4-6-13(7-5-12)16(18)19/h4-7H,3,8-10H2,1-2H3,(H,18,19)
InChI Key:
BOONCUCOMIPBJA-UHFFFAOYSA-N
SMILES:
CCCOCCOc1nc(sc1C)c1ccc(cc1)C(=O)O
Properties
Complexity:
347
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.103g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
321.391g/mol
Monoisotopic Mass:
321.103g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
96.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
Literature
| Title | Journal |
|---|---|
| Design, synthesis, and structure-activity analysis of isoform-selective retinoic acid receptor beta ligands. | Journal of medicinal chemistry 20090326 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.