V021-0196 Screening compound: 1-[4-(3,4-DIFLUOROPHENOXY)-2-(1-PYRROLIDINYL)-7,8-DIHYDROPYRIDO[4,3-D]PYRIMIDIN-6(5H)-YL]-2-(2-THIENYL)-1-ETHANONE

V021-0196 Screening compound: 1-[4-(3,4-DIFLUOROPHENOXY)-2-(1-PYRROLIDINYL)-7,8-DIHYDROPYRIDO[4,3-D]PYRIMIDIN-6(5H)-YL]-2-(2-THIENYL)-1-ETHANONE
V021-0196 Screening compound: 1-[4-(3,4-DIFLUOROPHENOXY)-2-(1-PYRROLIDINYL)-7,8-DIHYDROPYRIDO[4,3-D]PYRIMIDIN-6(5H)-YL]-2-(2-THIENYL)-1-ETHANONE alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-0196
1-[4-(3,4-DIFLUOROPHENOXY)-2-(1-PYRROLIDINYL)-7,8-DIHYDROPYRIDO[4,3-D]PYRIMIDIN-6(5H)-YL]-2-(2-THIENYL)-1-ETHANONE

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

V021-0196

Molecular Formula

C23H22F2N4O2S (C23 H22 F2 N4 O2 S)

Compound Name

1-[4-(3,4-DIFLUOROPHENOXY)-2-(1-PYRROLIDINYL)-7,8-DIHYDROPYRIDO[4,3-D]PYRIMIDIN-6(5H)-YL]-2-(2-THIENYL)-1-ETHANONE

IUPAC name

n/a

SMILES

O=C(Cc1cccs1)N(CCc1nc(N2CCCC2)n2)Cc1c2Oc(cc1)cc(F)c1F

InChI

InChI=1S/C23H22F2N4O2S/c24-18-6-5-15(12-19(18)25)31-22-17-14-29(21(30)13-16-4-3-11-32-16)10-7-20(17)26-23(27-22)28-8-1-2-9-28/h3-6,11-12H,1-2,7-10,13-14H2

InChI Key

RZNXCYVAXIMWKC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19979929

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

456.52

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.736

Distribution Coefficient, logD

4.736

Water Solubility, LogSw

-4.83

Polar Surface Area

47.362

Acid Dissociation Constant (pKa)

19.71

Base Dissociation Constant (pKb)

3.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

V021-0196 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with V021-0196 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-0196?
Check Price and Availability of V021-0196, 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 V021-0196 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-0196
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-0196
  • 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 V021-0196 available by request