Products for Research Use Only
RegisterLogin

BTRX-335140 50mg

CAT: 0628-A18583-50Size: 50 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0628-A18583-50Size:50 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
2244614-14-8

Chemical Information

1-(6-Ethyl-8-fluoro-4-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-2-quinolinyl)-N-(tetrahydro-2H-pyran-4-yl)-4-piperidinamine

BTRX-335140 is under investigation in clinical trial NCT04221230 (Study in Major Depressive Disorder With BTRX-335140 vs Placebo).

CAS Number2244614-14-8
PubChem CID137434175
IUPAC Name1-[6-ethyl-8-fluoro-4-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]-N-(oxan-4-yl)piperidin-4-amine
Molecular FormulaC25H32FN5O2
Molecular Weight453.6
XLogP4.7
Topological Polar Surface Area76.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count5
Heavy Atom Count33
Formal Charge0
Complexity630
SMILES
CCC1=CC2=C(C(=C(N=C2C(=C1)F)N3CCC(CC3)NC4CCOCC4)C5=NC(=NO5)C)C
InChI
InChI=1S/C25H32FN5O2/c1-4-17-13-20-15(2)22(25-27-16(3)30-33-25)24(29-23(20)21(26)14-17)31-9-5-18(6-10-31)28-19-7-11-32-12-8-19/h13-14,18-19,28H,4-12H2,1-3H3
InChIKey
CQOJHAJWCDJEAT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-(6-Ethyl-8-fluoro-4-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-2-quinolinyl)-N-(tetrahydro-2H-pyran-4-yl)-4-piperidinamine
CAS: 2244614-14-8
CID: 137434175
Formula: C25H32FN5O2
MW: 453.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight453.6
XLogP34.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count5
Exact Mass453.25400344
Monoisotopic Mass453.25400344
Topological Polar Surface Area76.3 Ų
Heavy Atom Count33
Formal Charge0
Complexity630
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
A18583-10BTRX-335140 10mg
A18583-1BTRX-335140 1mg
A18583-25BTRX-335140 25mg
A18583-5BTRX-335140 5mg
A18583-2BTRX-335140 2mg
A18583-100BTRX-335140 100mg
A18583-200BTRX-335140 200mg
A18583-10mM-DBTRX-335140 10mM * 1mL in DMSO
A19255-50BTR-1 50mg
A24083-50DBPR728 50mg

Alternative Products

CatalogName
GTR19175081-01BTRX-335140
1871-50mgTDM, 50mg
PPCBRPC010L50GA50mg/1mL
1362-50mgABTS, 50mg
LC526(FAT BLASTER) L-Carnitine 300mg Methionine 25mg Inositol 50mg Choline 50mg B12 1mg B6 50mg NADH 50mg
005PM-033-100Welchrom Carb/PSA, 50mg/50mg/1mL, 100pcs/pk
CA003-001Gentamicin, 50mg/ml
OOMC00076-50MGOOMC00076-50MG - Ritonavir
OOMC00060-50MGOOMC00060-50MG - Tigecycline
OOMC00025-50MGOOMC00025-50MG - Entacapone

Popular Products