C522-0622 Screening compound: N-butyl-1-{[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}piperidine-4-carboxamide

C522-0622 Screening compound: N-butyl-1-{[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}piperidine-4-carboxamide
C522-0622 Screening compound: N-butyl-1-{[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C522-0622
N-butyl-1-{[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}piperidine-4-carboxamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

C522-0622

Molecular Formula

C23H33N3O4 (C23 H33 N3 O4)

Compound Name

N-butyl-1-{[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}piperidine-4-carboxamide

IUPAC name

N-butyl-1-{[2-(34-dimethoxyphenyl)-5-methyl-13-oxazol-4-yl]methyl}piperidine-4-carboxamide

SMILES

CCCCNC(C1CCN(Cc2c(C)oc(-c(cc3)cc(OC)c3OC)n2)CC1)=O

InChI

InChI=1S/C23H33N3O4/c1-5-6-11-24-22(27)17-9-12-26(13-10-17)15-19-16(2)30-23(25-19)18-7-8-20(28-3)21(14-18)29-4/h7-8,14,17H,5-6,9-13,15H2,1-4H3,(H,24,27)

InChI Key

XEMLTXHUHFRPMJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14765651

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

415.53

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.860

Distribution Coefficient, logD

1.901

Water Solubility, LogSw

-3.09

Polar Surface Area

61.880

Acid Dissociation Constant (pKa)

14.41

Base Dissociation Constant (pKb)

8.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

56.52

C522-0622 in Drug Discovery

Included in Screening Libraries

Immunological Library (6760 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with C522-0622 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C522-0622?
Check Price and Availability of C522-0622, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of C522-0622 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C522-0622
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C522-0622
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of C522-0622 available by request