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Pentiapine

CAS No.:
81382-51-6
Catalog Number:
AG00GJLN
Molecular Formula:
C15H17N5S
Molecular Weight:
299.3940
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
99%
1 week
United States
$1100
- +
5mg
99%
1 week
United States
$1726
- +
10mg
99%
1 week
United States
$2728
- +
Product Description
Catalog Number:
AG00GJLN
Chemical Name:
Pentiapine
CAS Number:
81382-51-6
Molecular Formula:
C15H17N5S
Molecular Weight:
299.3940
MDL Number:
MFCD09838073
IUPAC Name:
5-(4-methylpiperazin-1-yl)imidazo[2,1-b][1,3,5]benzothiadiazepine
InChI:
InChI=1S/C15H17N5S/c1-18-8-10-19(11-9-18)14-17-12-4-2-3-5-13(12)21-15-16-6-7-20(14)15/h2-7H,8-11H2,1H3
InChI Key:
FACMWMBWGSPRKO-UHFFFAOYSA-N
SMILES:
CN1CCN(CC1)C1=Nc2ccccc2Sc2n1ccn2
UNII:
RAP39VD6P5
Properties
Complexity:
407  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.12g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
299.396g/mol
Monoisotopic Mass:
299.12g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
62A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Literature
Title Journal
Role of the dopaminergic system in the acquisition, expression and reinstatement of MDMA-induced conditioned place preference in adolescent mice. PloS one 20120101
The dopamine release inhibitor CGS 10746B blocks conditioned physical signs of morphine withdrawal. Addiction biology 20030601
Effects of CGS 10746B on hyperactivity and place preference induced by morphine. Behavioural brain research 20011129
Properties