200,000+ products from a single source!
sales@angenechem.com
100879-60-5 | 1-Isoquinolineacetic acid, 1,2,3,4-tetrahydro-6,7-dimethoxy-2-(methylsulfonyl)-, hydrazide
CAS No: 100879-60-5 Catalog No: AG00033G MDL No:MFCD06336104
Product Description
Catalog Number:
AG00033G
Chemical Name:
1-Isoquinolineacetic acid, 1,2,3,4-tetrahydro-6,7-dimethoxy-2-(methylsulfonyl)-, hydrazide
CAS Number:
100879-60-5
Molecular Formula:
C14H21N3O5S
Molecular Weight:
343.3986
MDL Number:
MFCD06336104
IUPAC Name:
2-(6,7-dimethoxy-2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-1-yl)acetohydrazide
InChI:
InChI=1S/C14H21N3O5S/c1-21-12-6-9-4-5-17(23(3,19)20)11(8-14(18)16-15)10(9)7-13(12)22-2/h6-7,11H,4-5,8,15H2,1-3H3,(H,16,18)
InChI Key:
IBAHFQQQODSARR-UHFFFAOYSA-N
SMILES:
NNC(=O)CC1c2cc(OC)c(cc2CCN1S(=O)(=O)C)OC
Properties
Complexity:
521
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
343.12g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
343.398g/mol
Monoisotopic Mass:
343.12g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
119A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.