200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 2022-29-9
2022-29-9 | Spiperone hydrochloride
CAS No: 2022-29-9 Catalog No: AG005GGA MDL No:
Product Description
Catalog Number:
AG005GGA
Chemical Name:
Spiperone hydrochloride
CAS Number:
2022-29-9
Molecular Formula:
C23H27ClFN3O2
Molecular Weight:
431.9308
IUPAC Name:
8-[4-(4-fluorophenyl)-4-oxobutyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one;hydrochloride
InChI:
InChI=1S/C23H26FN3O2.ClH/c24-19-10-8-18(9-11-19)21(28)7-4-14-26-15-12-23(13-16-26)22(29)25-17-27(23)20-5-2-1-3-6-20;/h1-3,5-6,8-11H,4,7,12-17H2,(H,25,29);1H
InChI Key:
QUIKMLCZZMOBLH-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)C(=O)NCN2c1ccccc1.Cl
Properties
Complexity:
577
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
431.178g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
431.936g/mol
Monoisotopic Mass:
431.178g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
| Title | Journal |
|---|---|
| Genetic mapping of targets mediating differential chemical phenotypes in Plasmodium falciparum. | Nature chemical biology 20091001 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.