V017-3228 Screening compound: 1-[6-(2-chlorobenzoyl)-4-(2-methoxyphenoxy)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-yl]-4-methylpiperazine

V017-3228 Screening compound: 1-[6-(2-chlorobenzoyl)-4-(2-methoxyphenoxy)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-yl]-4-methylpiperazine
V017-3228 Screening compound: 1-[6-(2-chlorobenzoyl)-4-(2-methoxyphenoxy)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-yl]-4-methylpiperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound V017-3228
1-[6-(2-chlorobenzoyl)-4-(2-methoxyphenoxy)-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

V017-3228

Molecular Formula

C26H28ClN5O3 (C26 H28 ClN5 O3)

Compound Name

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

IUPAC name

1-[6-(2-chlorobenzoyl)-4-(2-methoxyphenoxy)-5H6H7H8H-pyrido[43-d]pyrimidin-2-yl]-4-methylpiperazine

SMILES

CN(CC1)CCN1c1nc(Oc(cccc2)c2OC)c(CN(CC2)C(c(cccc3)c3Cl)=O)c2n1

InChI

InChI=1S/C26H28ClN5O3/c1-30-13-15-31(16-14-30)26-28-21-11-12-32(25(33)18-7-3-4-8-20(18)27)17-19(21)24(29-26)35-23-10-6-5-9-22(23)34-2/h3-10H,11-17H2,1-2H3

InChI Key

HCQMEHVABVDAOG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19933683

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

493.99

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.059

Distribution Coefficient, logD

3.487

Water Solubility, LogSw

-4.45

Polar Surface Area

57.699

Acid Dissociation Constant (pKa)

19.92

Base Dissociation Constant (pKb)

7.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.62

V017-3228 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Antifungal Library (16415 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with V017-3228 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V017-3228?
Check Price and Availability of V017-3228, 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 V017-3228 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V017-3228
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V017-3228
  • 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 V017-3228 available by request