V028-0006 Screening compound: 1-[6-(3-CHLORO-4-FLUOROPHENOXY)PYRIMIDIN-4-YL]-4-(4-FLUOROBENZOYL)-1,4-DIAZEPANE

V028-0006 Screening compound: 1-[6-(3-CHLORO-4-FLUOROPHENOXY)PYRIMIDIN-4-YL]-4-(4-FLUOROBENZOYL)-1,4-DIAZEPANE
V028-0006 Screening compound: 1-[6-(3-CHLORO-4-FLUOROPHENOXY)PYRIMIDIN-4-YL]-4-(4-FLUOROBENZOYL)-1,4-DIAZEPANE alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-0006
1-[6-(3-CHLORO-4-FLUOROPHENOXY)PYRIMIDIN-4-YL]-4-(4-FLUOROBENZOYL)-1,4-DIAZEPANE

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

V028-0006

Molecular Formula

C22H19ClF2N4O2 (C22 H19 ClF2 N4 O2)

Compound Name

1-[6-(3-CHLORO-4-FLUOROPHENOXY)PYRIMIDIN-4-YL]-4-(4-FLUOROBENZOYL)-1,4-DIAZEPANE

IUPAC name

n/a

SMILES

O=C(c(cc1)ccc1F)N(CCC1)CCN1c1cc(Oc(cc2)cc(Cl)c2F)ncn1

InChI

InChI=1S/C22H19ClF2N4O2/c23-18-12-17(6-7-19(18)25)31-21-13-20(26-14-27-21)28-8-1-9-29(11-10-28)22(30)15-2-4-16(24)5-3-15/h2-7,12-14H,1,8-11H2

InChI Key

OSZFHAHFWOIEKM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19861936

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

444.87

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.197

Distribution Coefficient, logD

4.197

Water Solubility, LogSw

-4.47

Polar Surface Area

46.400

Acid Dissociation Constant (pKa)

23.29

Base Dissociation Constant (pKb)

2.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

V028-0006 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with V028-0006 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-0006?
Check Price and Availability of V028-0006, 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 V028-0006 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-0006
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-0006
  • 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 V028-0006 available by request