200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 480-94-4
480-94-4 | 1H-Indole-3-thiol
CAS No: 480-94-4 Catalog No: AG00I8QZ MDL No:MFCD00152110
Product Description
Catalog Number:
AG00I8QZ
Chemical Name:
1H-Indole-3-thiol
CAS Number:
480-94-4
Molecular Formula:
C8H7NS
Molecular Weight:
149.2129
MDL Number:
MFCD00152110
IUPAC Name:
1H-indole-3-thiol
InChI:
InChI=1S/C8H7NS/c10-8-5-9-7-4-2-1-3-6(7)8/h1-5,9-10H
InChI Key:
LYFRUBQVZGVXPR-UHFFFAOYSA-N
SMILES:
Sc1c[nH]c2c1cccc2
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.03g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
149.211g/mol
Monoisotopic Mass:
149.03g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
16.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
Literature
| Title | Journal |
|---|---|
| Substituted indole-1-acetic acids as potent and selective CRTh2 antagonists-discovery of AZD1981. | Bioorganic & medicinal chemistry letters 20111101 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.