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Details

Stereochemistry ACHIRAL
Molecular Formula C23H26N6O3S.2ClH
Molecular Weight 539.478
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ROGARATINIB DIHYDROCHLORIDE

SMILES

Cl.Cl.COCC1=C(CN2CCNC(=O)C2)N3N=CN=C(N)C3=C1C4=CC5=CC(C)=CC(OC)=C5S4

InChI

InChIKey=GHOABSBCUJAZCB-UHFFFAOYSA-N
InChI=1S/C23H26N6O3S.2ClH/c1-13-6-14-8-18(33-22(14)17(7-13)32-3)20-15(11-31-2)16(9-28-5-4-25-19(30)10-28)29-21(20)23(24)26-12-27-29;;/h6-8,12H,4-5,9-11H2,1-3H3,(H,25,30)(H2,24,26,27);2*1H

HIDE SMILES / InChI

Molecular Formula C23H26N6O3S
Molecular Weight 466.556
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:24:37 GMT 2023
Edited
by admin
on Sat Dec 16 12:24:37 GMT 2023
Record UNII
25AM6LVL9J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ROGARATINIB DIHYDROCHLORIDE
Common Name English
2-PIPERAZINONE, 4-((4-AMINO-6-(METHOXYMETHYL)-5-(7-METHOXY-5-METHYLBENZO(B)THIEN-2-YL)PYRROLO(2,1-F)(1,2,4)TRIAZIN-7-YL)METHYL)-, HYDROCHLORIDE (1:2)
Systematic Name English
Code System Code Type Description
SMS_ID
300000013065
Created by admin on Sat Dec 16 12:24:37 GMT 2023 , Edited by admin on Sat Dec 16 12:24:37 GMT 2023
PRIMARY
FDA UNII
25AM6LVL9J
Created by admin on Sat Dec 16 12:24:37 GMT 2023 , Edited by admin on Sat Dec 16 12:24:37 GMT 2023
PRIMARY
CAS
1443530-07-1
Created by admin on Sat Dec 16 12:24:37 GMT 2023 , Edited by admin on Sat Dec 16 12:24:37 GMT 2023
PRIMARY
PUBCHEM
71611870
Created by admin on Sat Dec 16 12:24:37 GMT 2023 , Edited by admin on Sat Dec 16 12:24:37 GMT 2023
PRIMARY
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