200,000+ products from a single source!
sales@angenechem.com
887354-19-0 | Dabsylaminoethyl Methanethiosulfonate
CAS No: 887354-19-0 Catalog No: AG0045I6 MDL No:
Product Description
Catalog Number:
AG0045I6
Chemical Name:
Dabsylaminoethyl Methanethiosulfonate
CAS Number:
887354-19-0
Molecular Formula:
C17H22N4O4S3
Molecular Weight:
442.5760
IUPAC Name:
4-[[4-(dimethylamino)phenyl]diazenyl]-N-(2-methylsulfonylsulfanylethyl)benzenesulfonamide
InChI:
InChI=1S/C17H22N4O4S3/c1-21(2)16-8-4-14(5-9-16)19-20-15-6-10-17(11-7-15)28(24,25)18-12-13-26-27(3,22)23/h4-11,18H,12-13H2,1-3H3
InChI Key:
URGLPBPCBBYYPB-UHFFFAOYSA-N
SMILES:
CN(c1ccc(cc1)N=Nc1ccc(cc1)S(=O)(=O)NCCSS(=O)(=O)C)C
Properties
Complexity:
698
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
442.08g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
442.567g/mol
Monoisotopic Mass:
442.08g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
150A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.