V007-5616 Screening compound: 1-[5-(2H-1,3-benzodioxol-5-yl)-3-methyl-1,2-oxazole-4-carbonyl]-4-[(4-fluorophenyl)methyl]piperidine

V007-5616 Screening compound: 1-[5-(2H-1,3-benzodioxol-5-yl)-3-methyl-1,2-oxazole-4-carbonyl]-4-[(4-fluorophenyl)methyl]piperidine
V007-5616 Screening compound: 1-[5-(2H-1,3-benzodioxol-5-yl)-3-methyl-1,2-oxazole-4-carbonyl]-4-[(4-fluorophenyl)methyl]piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-5616
1-[5-(2H-1,3-benzodioxol-5-yl)-3-methyl-1,2-oxazole-4-carbonyl]-4-[(4-fluorophenyl)methyl]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

V007-5616

Molecular Formula

C24H23FN2O4 (C24 H23 FN2 O4)

Compound Name

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

IUPAC name

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

SMILES

Cc1noc(-c(cc2)cc3c2OCO3)c1C(N1CCC(Cc(cc2)ccc2F)CC1)=O

InChI

InChI=1S/C24H23FN2O4/c1-15-22(23(31-26-15)18-4-7-20-21(13-18)30-14-29-20)24(28)27-10-8-17(9-11-27)12-16-2-5-19(25)6-3-16/h2-7,13,17H,8-12,14H2,1H3

InChI Key

LPJWDMZXDSJJBR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19959447

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.46

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

4.898

Distribution Coefficient, logD

4.898

Water Solubility, LogSw

-4.92

Polar Surface Area

56.076

Acid Dissociation Constant (pKa)

25.45

Base Dissociation Constant (pKb)

-1.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

V007-5616 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with V007-5616 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-5616?
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What is the minimum amount of V007-5616 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-5616
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-5616
  • 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 V007-5616 available by request