BPDBA

CAT: 0607-BA6669-100Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0607-BA6669-100Size:100 mg

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

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CAS Number

312281-74-6

Form

A solid

Molecular Formula

C19H20Cl2N2O

Molecular Weight

363.28

Shipping Conditions

Blue ice

Storage Conditions

-20°C.

Chemical Information

N-(1-benzyl-4-piperidinyl)-2,4-dichlorobenzamide

inhibits the betaine-GABA transporter 1; structure in first source

CAS Number	312281-74-6
PubChem CID	1069892
IUPAC Name	N-(1-benzylpiperidin-4-yl)-2,4-dichlorobenzamide
Molecular Formula	C19H20Cl2N2O
Molecular Weight	363.3
XLogP	4.5
Topological Polar Surface Area	32.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	4
Heavy Atom Count	24
Formal Charge	0
Complexity	406

SMILES

C1CN(CCC1NC(=O)C2=C(C=C(C=C2)Cl)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C19H20Cl2N2O/c20-15-6-7-17(18(21)12-15)19(24)22-16-8-10-23(11-9-16)13-14-4-2-1-3-5-14/h1-7,12,16H,8-11,13H2,(H,22,24)

InChIKey

OIDACLQVAGIDMT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 312281-74-6

CID: 1069892

Formula: C19H20Cl2N2O

MW: 363.3

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	363.3
XLogP3	4.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	4
Exact Mass	362.0952687
Monoisotopic Mass	362.0952687
Topological Polar Surface Area	32.3 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	406
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
T26891-01	BPDBA