Org 24461

CAT: 0931-T69339-01Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0931-T69339-01Size:25 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

372198-80-6

Target

Others

Related Pathways

Others

Bioactivity

Org 24461 is a synaptic and nonsynaptic glycine transporter type-1 inhibitor.

Smiles

C(OC1=CC=C(C(F)(F)F)C=C1)(CCN(CC(O)=O)C)C2=CC=CC=C2

Molecular Formula

C19H20F3NO3

Molecular Weight

367.36

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Org 24461

structure in first source

CAS Number	372198-80-6
PubChem CID	10044847
IUPAC Name	2-[methyl-[3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]amino]acetic acid
Molecular Formula	C19H20F3NO3
Molecular Weight	367.4
XLogP	1.8
Topological Polar Surface Area	49.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	8
Heavy Atom Count	26
Formal Charge	0
Complexity	430

SMILES

CN(CCC(C1=CC=CC=C1)OC2=CC=C(C=C2)C(F)(F)F)CC(=O)O

InChI

InChI=1S/C19H20F3NO3/c1-23(13-18(24)25)12-11-17(14-5-3-2-4-6-14)26-16-9-7-15(8-10-16)19(20,21)22/h2-10,17H,11-13H2,1H3,(H,24,25)

InChIKey

KZWQAWBTWNPFPW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 372198-80-6

CID: 10044847

Formula: C19H20F3NO3

MW: 367.4

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	367.4
XLogP3	1.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	8
Exact Mass	367.13952799
Monoisotopic Mass	367.13952799
Topological Polar Surface Area	49.8 Å²
Heavy Atom Count	26
Formal Charge	0
Complexity	430
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Org 24461

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