AC-271337

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H26FN3O3
Molecular Weight	387.4478
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=CC=C(CNC(=O)N(CC2=CC=C(F)C=C2)C3CCNCC3)C=C1O

InChI

InChIKey=CUNQZXQNVAQMPV-UHFFFAOYSA-N

InChI=1S/C21H26FN3O3/c1-28-20-7-4-16(12-19(20)26)13-24-21(27)25(18-8-10-23-11-9-18)14-15-2-5-17(22)6-3-15/h2-7,12,18,23,26H,8-11,13-14H2,1H3,(H,24,27)

HIDE SMILES / InChI

Molecular Formula	C21H26FN3O3
Molecular Weight	387.4478
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 `Tue Apr 01 23:51:50 GMT 2025` Edited by `admin` on `Tue Apr 01 23:51:50 GMT 2025`
Record UNII	XQQ9VUC27W
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PIMAVANSERIN METABOLITE (AC-271337)

Preferred Name

English

AC-271337

Code

English

1-((4-FLUOROPHENYL)METHYL)-3-((3-HYDROXY-4-METHOXY-PHENYL)METHYL)-1-(4-PIPERIDYL)UREA

Systematic Name

English

UREA, N-((4-FLUOROPHENYL)METHYL)-N'-((3-HYDROXY-4-METHOXYPHENYL)METHYL)-N-4-PIPERIDINYL-

Systematic Name

English

Code System Code Type Description

FDA UNII

XQQ9VUC27W

Created by admin on Tue Apr 01 23:51:50 GMT 2025 , Edited by admin on Tue Apr 01 23:51:50 GMT 2025

PRIMARY

PUBCHEM

68789782

Created by admin on Tue Apr 01 23:51:50 GMT 2025 , Edited by admin on Tue Apr 01 23:51:50 GMT 2025

PRIMARY

CAS

1246494-36-9

Created by admin on Tue Apr 01 23:51:50 GMT 2025 , Edited by admin on Tue Apr 01 23:51:50 GMT 2025

PRIMARY

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PIMAVANSERIN

PARENT -> METABOLITE