V021-0605 Screening compound: 1-[4-(3,4-difluorophenoxy)-6-[(3,5-dimethoxyphenyl)methyl]-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-yl]piperidine

V021-0605 Screening compound: 1-[4-(3,4-difluorophenoxy)-6-[(3,5-dimethoxyphenyl)methyl]-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-yl]piperidine
V021-0605 Screening compound: 1-[4-(3,4-difluorophenoxy)-6-[(3,5-dimethoxyphenyl)methyl]-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-yl]piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-0605
1-[4-(3,4-difluorophenoxy)-6-[(3,5-dimethoxyphenyl)methyl]-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-yl]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

V021-0605

Molecular Formula

C27H30F2N4O3 (C27 H30 F2 N4 O3)

Compound Name

1-[4-(3,4-difluorophenoxy)-6-[(3,5-dimethoxyphenyl)methyl]-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-yl]piperidine

IUPAC name

1-[4-(34-difluorophenoxy)-6-[(35-dimethoxyphenyl)methyl]-5H6H7H8H-pyrido[43-d]pyrimidin-2-yl]piperidine

SMILES

COc1cc(CN(CC2)Cc3c2nc(N2CCCCC2)nc3Oc(cc2)cc(F)c2F)cc(OC)c1

InChI

InChI=1S/C27H30F2N4O3/c1-34-20-12-18(13-21(14-20)35-2)16-32-11-8-25-22(17-32)26(36-19-6-7-23(28)24(29)15-19)31-27(30-25)33-9-4-3-5-10-33/h6-7,12-15H,3-5,8-11,16-17H2,1-2H3

InChI Key

LQDJOKJDSOIPOA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19932480

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

496.56

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.977

Distribution Coefficient, logD

5.391

Water Solubility, LogSw

-5.53

Polar Surface Area

48.677

Acid Dissociation Constant (pKa)

20.48

Base Dissociation Constant (pKb)

7.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.70

V021-0605 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with V021-0605 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-0605?
Check Price and Availability of V021-0605, 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 V021-0605 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-0605
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-0605
  • 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 V021-0605 available by request