V007-6906 Screening compound: 3-chloro-1-{2-[5-(4-fluoro-3-methylphenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl}-2,2-dimethylpropan-1-one

V007-6906 Screening compound: 3-chloro-1-{2-[5-(4-fluoro-3-methylphenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl}-2,2-dimethylpropan-1-one
V007-6906 Screening compound: 3-chloro-1-{2-[5-(4-fluoro-3-methylphenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl}-2,2-dimethylpropan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-6906
3-chloro-1-{2-[5-(4-fluoro-3-methylphenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl}-2,2-dimethylpropan-1-one

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

V007-6906

Molecular Formula

C23H24ClFN2O2 (C23 H24 ClFN2 O2)

Compound Name

3-chloro-1-{2-[5-(4-fluoro-3-methylphenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl}-2,2-dimethylpropan-1-one

IUPAC name

3-chloro-1-{2-[5-(4-fluoro-3-methylphenyl)-13-benzoxazol-2-yl]pyrrolidin-1-yl}-22-dimethylpropan-1-one

SMILES

CC(C)(CCl)C(N(CCC1)C1c1nc(cc(cc2)-c(cc3)cc(C)c3F)c2o1)=O

InChI

InChI=1S/C23H24ClFN2O2/c1-14-11-15(6-8-17(14)25)16-7-9-20-18(12-16)26-21(29-20)19-5-4-10-27(19)22(28)23(2,3)13-24/h6-9,11-12,19H,4-5,10,13H2,1-3H3/t19-/m0/s1

InChI Key

LCUZOIWTQVYHIX-IBGZPJMESA-N

MDL Number (MFCD)

MFCD19969506

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.91

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.813

Distribution Coefficient, logD

5.813

Water Solubility, LogSw

-5.68

Polar Surface Area

33.757

Acid Dissociation Constant (pKa)

27.13

Base Dissociation Constant (pKb)

-3.49

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

39.10

V007-6906 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Neuropeptide S Library (2850 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Digestive system
  • Nervous system
Mechanism of action:
  • Epigenetic
  • Receptor's ligands
Targets:
  • GPCR

References: we are preparing a list of scientific research reports with V007-6906 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-6906?
Check Price and Availability of V007-6906, 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 V007-6906 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-6906
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-6906
  • 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 V007-6906 available by request