200,000+ products from a single source!
sales@angenechem.com
Home > Quinoline > 435273-39-5
435273-39-5 | ISOQUINOLINE-1-CARBOTHIOIC ACID AMIDE
CAS No: 435273-39-5 Catalog No: AG00D8C3 MDL No:MFCD06738916
Product Description
Catalog Number:
AG00D8C3
Chemical Name:
ISOQUINOLINE-1-CARBOTHIOIC ACID AMIDE
CAS Number:
435273-39-5
Molecular Formula:
C10H8N2S
Molecular Weight:
188.2489
MDL Number:
MFCD06738916
IUPAC Name:
isoquinoline-1-carbothioamide
InChI:
InChI=1S/C10H8N2S/c11-10(13)9-8-4-2-1-3-7(8)5-6-12-9/h1-6H,(H2,11,13)
InChI Key:
HLWSLJSWUSSKDL-UHFFFAOYSA-N
SMILES:
NC(=S)c1nccc2c1cccc2
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.041g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
188.248g/mol
Monoisotopic Mass:
188.041g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
71A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.