200,000+ products from a single source!
sales@angenechem.com
872593-17-4 | 1H-Indole-2-carboxylic acid, 3-[(dodecylamino)sulfonyl]-1-methyl-
CAS No: 872593-17-4 Catalog No: AG004PZ1 MDL No:
Product Description
Catalog Number:
AG004PZ1
Chemical Name:
1H-Indole-2-carboxylic acid, 3-[(dodecylamino)sulfonyl]-1-methyl-
CAS Number:
872593-17-4
Molecular Formula:
C22H34N2O4S
Molecular Weight:
422.5814
IUPAC Name:
3-(dodecylsulfamoyl)-1-methylindole-2-carboxylic acid
InChI:
InChI=1S/C22H34N2O4S/c1-3-4-5-6-7-8-9-10-11-14-17-23-29(27,28)21-18-15-12-13-16-19(18)24(2)20(21)22(25)26/h12-13,15-16,23H,3-11,14,17H2,1-2H3,(H,25,26)
InChI Key:
FXQASCZDHINUMX-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCNS(=O)(=O)c1c2ccccc2n(c1C(=O)O)C
Properties
Complexity:
590
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
422.224g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
422.584g/mol
Monoisotopic Mass:
422.224g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
96.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.