V030-0500 Screening compound: 6-CHLORO-N-[(5-FLUORO-2,3-DIHYDRO-1-BENZOFURAN-2-YL)METHYL]PYRIDINE-3-CARBOXAMIDE

V030-0500 Screening compound: 6-CHLORO-N-[(5-FLUORO-2,3-DIHYDRO-1-BENZOFURAN-2-YL)METHYL]PYRIDINE-3-CARBOXAMIDE
V030-0500 Screening compound: 6-CHLORO-N-[(5-FLUORO-2,3-DIHYDRO-1-BENZOFURAN-2-YL)METHYL]PYRIDINE-3-CARBOXAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-0500
6-CHLORO-N-[(5-FLUORO-2,3-DIHYDRO-1-BENZOFURAN-2-YL)METHYL]PYRIDINE-3-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

V030-0500

Molecular Formula

C15H12ClFN2O2 (C15 H12 ClFN2 O2)

Compound Name

6-CHLORO-N-[(5-FLUORO-2,3-DIHYDRO-1-BENZOFURAN-2-YL)METHYL]PYRIDINE-3-CARBOXAMIDE

IUPAC name

n/a

SMILES

O=C(c(cc1)cnc1Cl)NCC(C1)Oc(cc2)c1cc2F

InChI

InChI=1S/C15H12ClFN2O2/c16-14-4-1-9(7-18-14)15(20)19-8-12-6-10-5-11(17)2-3-13(10)21-12/h1-5,7,12H,6,8H2,(H,19,20)/t12-/m1/s1

InChI Key

YWGSOGRURNVAQB-GFCCVEGCSA-N

MDL Number (MFCD)

MFCD19952379

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

306.72

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.526

Distribution Coefficient, logD

2.526

Water Solubility, LogSw

-3.44

Polar Surface Area

41.252

Acid Dissociation Constant (pKa)

11.74

Base Dissociation Constant (pKb)

-0.85

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.00

V030-0500 in Drug Discovery

Included in Screening Libraries

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with V030-0500 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-0500?
Check Price and Availability of V030-0500, 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 V030-0500 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-0500
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-0500
  • 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 V030-0500 available by request