1H-INDOLE-2-CARBOXYLIC ACID, 4-FLUORO-5-((6-METHOXY-7-(3-(1-PYRROLIDINYL)PROPOXY)-4-QUINAZOLINYL)OXY)-

Details

Stereochemistry	ACHIRAL
Molecular Formula	C25H25FN4O5
Molecular Weight	480.4882
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1H-INDOLE-2-CARBOXYLIC ACID, 4-FLUORO-5-((6-METHOXY-7-(3-(1-PYRROLIDINYL)PROPOXY)-4-QUINAZOLINYL)OXY)-

Structure Search

SMILES

COC1=C(OCCCN2CCCC2)C=C3N=CN=C(OC4=C(F)C5=C(NC(=C5)C(O)=O)C=C4)C3=C1

InChI

InChIKey=IKKAUYDPVIYEPI-UHFFFAOYSA-N

InChI=1S/C25H25FN4O5/c1-33-21-12-16-18(13-22(21)34-10-4-9-30-7-2-3-8-30)27-14-28-24(16)35-20-6-5-17-15(23(20)26)11-19(29-17)25(31)32/h5-6,11-14,29H,2-4,7-10H2,1H3,(H,31,32)

HIDE SMILES / InChI

Molecular Formula	C25H25FN4O5
Molecular Weight	480.4882
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 16:08:28 UTC 2023` Edited by `admin` on `Sat Dec 16 16:08:28 UTC 2023`
Record UNII	7SJ34L2BI5
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1H-INDOLE-2-CARBOXYLIC ACID, 4-FLUORO-5-((6-METHOXY-7-(3-(1-PYRROLIDINYL)PROPOXY)-4-QUINAZOLINYL)OXY)-

Systematic Name

English

CEDIRANIB METABOLITE M7

Common Name

English

Code System Code Type Description

FDA UNII

7SJ34L2BI5

Created by admin on Sat Dec 16 16:08:28 UTC 2023 , Edited by admin on Sat Dec 16 16:08:28 UTC 2023

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CAS

1245018-65-8

Created by admin on Sat Dec 16 16:08:28 UTC 2023 , Edited by admin on Sat Dec 16 16:08:28 UTC 2023

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PUBCHEM

154584962

Created by admin on Sat Dec 16 16:08:28 UTC 2023 , Edited by admin on Sat Dec 16 16:08:28 UTC 2023

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Related Record Type Details


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CEDIRANIB

PARENT -> METABOLITE

Comments:

IN VITRO

Interaction Type:

MINOR