AM2201 7-hydroxyindole metabolite

CAT: 0926-MLC88911-01Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0926-MLC88911-01Size:5 mg

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CAS Number

1537889-11-4

Smiles

C1=CC=C2C (=C1) C=CC=C2C (=O) C3=CN (C4=C3C=CC=C4O) CCCCCF

Molecular Formula

C24H22FNO2

Molecular Weight

375.4 g/mol

Controlled

Yes

Chemical Information

AM2201 7-hydroxyindole metabolite

CAS Number	1537889-11-4
PubChem CID	91738335
IUPAC Name	[1-(5-fluoropentyl)-7-hydroxyindol-3-yl]-naphthalen-1-ylmethanone
Molecular Formula	C24H22FNO2
Molecular Weight	375.4
XLogP	5.6
Topological Polar Surface Area	42.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	7
Heavy Atom Count	28
Formal Charge	0
Complexity	527

SMILES

C1=CC=C2C(=C1)C=CC=C2C(=O)C3=CN(C4=C3C=CC=C4O)CCCCCF

InChI

InChI=1S/C24H22FNO2/c25-14-4-1-5-15-26-16-21(19-11-7-13-22(27)23(19)26)24(28)20-12-6-9-17-8-2-3-10-18(17)20/h2-3,6-13,16,27H,1,4-5,14-15H2

InChIKey

WOWBAWORWZVPCY-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1537889-11-4

CID: 91738335

Formula: C24H22FNO2

MW: 375.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	375.4
XLogP3	5.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	7
Exact Mass	375.16345711
Monoisotopic Mass	375.16345711
Topological Polar Surface Area	42.2 Å²
Heavy Atom Count	28
Formal Charge	0
Complexity	527
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
CHC52135-01	AM2201 6-hydroxyindole metabolite
HCC80349-01	JWH 073 7-hydroxyindole metabolite
HCC80345-01	JWH 018 7-hydroxyindole metabolite
HCC80348-01	JWH 073 6-hydroxyindole metabolite
HCC80346-01	JWH 073 4-hydroxyindole metabolite
HCC80344-01	JWH 018 6-hydroxyindole metabolite
EFC60467-01	JWH 250 5-hydroxyindole metabolite
HCC80342-01	JWH 018 4-hydroxyindole metabolite
CHC32573-01	JWH 200 4-hydroxyindole metabolite
CHC32554-01	JWH 073 2-hydroxyindole metabolite

Catalog	Name
AR-I01505-01	JWH-250 5-Hydroxyindole Metabolite
AR-I01506-01	JWH-073 2-Hydroxyindole Metabolite
AR-I01509-01	JWH-018 2-Hydroxyindole Metabolite
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