200,000+ products from a single source!
sales@angenechem.com
Home > Quinoline > 1016512-58-5
1016512-58-5 | 3-(1,2,3,4-TETRAHYDROISOQUINOLIN-2-YL)PROPANETHIOAMIDE
CAS No: 1016512-58-5 Catalog No: AG01AREO MDL No:MFCD09931871
Product Description
Catalog Number:
AG01AREO
Chemical Name:
3-(1,2,3,4-TETRAHYDROISOQUINOLIN-2-YL)PROPANETHIOAMIDE
CAS Number:
1016512-58-5
Molecular Formula:
C12H16N2S
Molecular Weight:
220.3338
MDL Number:
MFCD09931871
IUPAC Name:
3-(3,4-dihydro-1H-isoquinolin-2-yl)propanethioamide
InChI:
InChI=1S/C12H16N2S/c13-12(15)6-8-14-7-5-10-3-1-2-4-11(10)9-14/h1-4H,5-9H2,(H2,13,15)
InChI Key:
SWUHOZJWHUEJOW-UHFFFAOYSA-N
SMILES:
NC(=S)CCN1CCc2c(C1)cccc2
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.103g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
220.334g/mol
Monoisotopic Mass:
220.103g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.