V008-6681 Screening compound: 4-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[5-(2-chlorophenyl)-3-methyl-1,2-oxazole-4-carbonyl]piperidine

V008-6681 Screening compound: 4-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[5-(2-chlorophenyl)-3-methyl-1,2-oxazole-4-carbonyl]piperidine
V008-6681 Screening compound: 4-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[5-(2-chlorophenyl)-3-methyl-1,2-oxazole-4-carbonyl]piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-6681
4-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[5-(2-chlorophenyl)-3-methyl-1,2-oxazole-4-carbonyl]piperidine

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

V008-6681

Molecular Formula

C24H23ClN2O4 (C24 H23 ClN2 O4)

Compound Name

4-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[5-(2-chlorophenyl)-3-methyl-1,2-oxazole-4-carbonyl]piperidine

IUPAC name

4-[(2H-13-benzodioxol-5-yl)methyl]-1-[5-(2-chlorophenyl)-3-methyl-12-oxazole-4-carbonyl]piperidine

SMILES

Cc1noc(-c(cccc2)c2Cl)c1C(N1CCC(Cc(cc2)cc3c2OCO3)CC1)=O

InChI

InChI=1S/C24H23ClN2O4/c1-15-22(23(31-26-15)18-4-2-3-5-19(18)25)24(28)27-10-8-16(9-11-27)12-17-6-7-20-21(13-17)30-14-29-20/h2-7,13,16H,8-12,14H2,1H3

InChI Key

NNNVZWVKZAITIF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19959459

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.91

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.271

Distribution Coefficient, logD

5.271

Water Solubility, LogSw

-5.77

Polar Surface Area

56.076

Acid Dissociation Constant (pKa)

25.45

Base Dissociation Constant (pKb)

-1.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with V008-6681 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-6681?
Check Price and Availability of V008-6681, 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 V008-6681 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-6681
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-6681
  • 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 V008-6681 available by request