Home Other Building Blocks Isoquinoline-5-thiocarboxamide

Isoquinoline-5-thiocarboxamide

CAS No.:
885272-56-0
Catalog Number:
AG0089ON
Molecular Formula:
C10H8N2S
Molecular Weight:
188.2489
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
≥ 95% (HPLC)
1 week
United States
$144
- +
250mg
≥ 95% (HPLC)
1 week
United States
$243
- +
1g
≥ 95% (HPLC)
1 week
United States
$446
- +
5g
≥ 95% (HPLC)
1 week
United States
$1823
- +
Product Description
Catalog Number:
AG0089ON
Chemical Name:
Isoquinoline-5-thiocarboxamide
CAS Number:
885272-56-0
Molecular Formula:
C10H8N2S
Molecular Weight:
188.2489
MDL Number:
MFCD06738973
IUPAC Name:
isoquinoline-5-carbothioamide
InChI:
InChI=1S/C10H8N2S/c11-10(13)9-3-1-2-7-6-12-5-4-8(7)9/h1-6H,(H2,11,13)
InChI Key:
DPEOEFCQYUIPSI-UHFFFAOYSA-N
SMILES:
NC(=S)c1cccc2c1ccnc2
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:
1.6  
Properties