Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C23H22ClN3O3S |
Molecular Weight | 455.957 |
Optical Activity | ( + ) |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=C(SC(=N1)C2=CC=C(Cl)C=C2)C(=O)N[C@H]3CCCN(C3)C4=CC(=CC=C4)C(O)=O
InChI
InChIKey=UEIFAMIUBPSKHA-SFHVURJKSA-N
InChI=1S/C23H22ClN3O3S/c1-14-20(31-22(25-14)15-7-9-17(24)10-8-15)21(28)26-18-5-3-11-27(13-18)19-6-2-4-16(12-19)23(29)30/h2,4,6-10,12,18H,3,5,11,13H2,1H3,(H,26,28)(H,29,30)/t18-/m0/s1
Molecular Formula | C23H22ClN3O3S |
Molecular Weight | 455.957 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 11:32:37 GMT 2023
by
admin
on
Sat Dec 16 11:32:37 GMT 2023
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Record UNII |
CB5UF7PNN7
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Record Status |
Validated (UNII)
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Record Version |
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-
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876145-69-6
Created by
admin on Sat Dec 16 11:32:38 GMT 2023 , Edited by admin on Sat Dec 16 11:32:38 GMT 2023
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11619439
Created by
admin on Sat Dec 16 11:32:38 GMT 2023 , Edited by admin on Sat Dec 16 11:32:38 GMT 2023
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CB5UF7PNN7
Created by
admin on Sat Dec 16 11:32:38 GMT 2023 , Edited by admin on Sat Dec 16 11:32:38 GMT 2023
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ENANTIOMER -> ENANTIOMER |
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ACTIVE MOIETY |
The pharmacokinetic (PK) profile of (S)-4f was also investigated. Results are summarized in Table 5. (S)-4f exhibited a good maximum concentration (Cmax = 315.7 ng/mL), good bioavailability (F = 47.6%), and a long half life (t1/2 = 10 h) when administered orally to rats at a dose of 1 mg/kg body weight. Administration to dogs (0.3 mg/kg, po) also resulted in satisfactory PK parameters (Cmax = 294.7 ng/mL, F = 73.1%, t1/2 = 74 h).
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ACTIVE MOIETY |
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ACTIVE MOIETY |
Mechanism of Action: Peroxisome proliferator-activated receptor alpha agonist; Highest Development Phase: Discontinued for Hyperlipidaemia; Most Recent Event: 07 Nov 2006 Preclinical trials in Hyperlipidaemia in Japan (unspecified route)
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