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146-28-1 | 2-[4-[3-(2-chlorophenothiazin-10-yl)propyl]piperazin-1-yl]ethyl acetate,dihydrochloride
CAS No: 146-28-1 Catalog No: AG0039G7 MDL No:
Product Description
Catalog Number:
AG0039G7
Chemical Name:
2-[4-[3-(2-chlorophenothiazin-10-yl)propyl]piperazin-1-yl]ethyl acetate,dihydrochloride
CAS Number:
146-28-1
Molecular Formula:
C23H30Cl3N3O2S
Molecular Weight:
518.9272
IUPAC Name:
2-[4-[3-(2-chlorophenothiazin-10-yl)propyl]piperazin-1-yl]ethyl acetate;dihydrochloride
InChI:
InChI=1S/C23H28ClN3O2S.2ClH/c1-18(28)29-16-15-26-13-11-25(12-14-26)9-4-10-27-20-5-2-3-6-22(20)30-23-8-7-19(24)17-21(23)27;;/h2-3,5-8,17H,4,9-16H2,1H3;2*1H
InChI Key:
DRLLEHPFGRESBT-UHFFFAOYSA-N
SMILES:
CC(=O)OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(Cl)cc2.Cl.Cl
EC Number:
205-666-8
UNII:
2K5E7BGM8X
Properties
Complexity:
561
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
517.112g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
518.922g/mol
Monoisotopic Mass:
517.112g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
61.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
| Title | Journal |
|---|---|
| Acetophenazine (Tindal) and thiopropazate (Dartal) in ambulatory psychoneurotic patients. | The American journal of psychiatry 19611001 |
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