V021-0653 Screening compound: 1-[6-(3-chlorobenzenesulfonyl)-4-(3,4-difluorophenoxy)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-yl]-4-methylpiperazine

V021-0653 Screening compound: 1-[6-(3-chlorobenzenesulfonyl)-4-(3,4-difluorophenoxy)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-yl]-4-methylpiperazine
V021-0653 Screening compound: 1-[6-(3-chlorobenzenesulfonyl)-4-(3,4-difluorophenoxy)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-yl]-4-methylpiperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-0653
1-[6-(3-chlorobenzenesulfonyl)-4-(3,4-difluorophenoxy)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-yl]-4-methylpiperazine

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

V021-0653

Molecular Formula

C24H24ClF2N5O3S (C24 H24 ClF2 N5 O3 S)

Compound Name

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

IUPAC name

1-[6-(3-chlorobenzenesulfonyl)-4-(34-difluorophenoxy)-5H6H7H8H-pyrido[43-d]pyrimidin-2-yl]-4-methylpiperazine

SMILES

CN(CC1)CCN1c1nc(Oc(cc2)cc(F)c2F)c(CN(CC2)S(c3cccc(Cl)c3)(=O)=O)c2n1

InChI

InChI=1S/C24H24ClF2N5O3S/c1-30-9-11-31(12-10-30)24-28-22-7-8-32(36(33,34)18-4-2-3-16(25)13-18)15-19(22)23(29-24)35-17-5-6-20(26)21(27)14-17/h2-6,13-14H,7-12,15H2,1H3

InChI Key

ZCKIKAJMYSQYLH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19933216

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

536

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.974

Distribution Coefficient, logD

4.402

Water Solubility, LogSw

-5.00

Polar Surface Area

65.045

Acid Dissociation Constant (pKa)

20.43

Base Dissociation Constant (pKb)

7.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

V021-0653 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anti-Inflammatory Library (24602 compounds)

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer

References: we are preparing a list of scientific research reports with V021-0653 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-0653?
Check Price and Availability of V021-0653, 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 V021-0653 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-0653
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-0653
  • 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 V021-0653 available by request