V020-9382 Screening compound: N-benzyl-6-(2,4-difluorobenzoyl)-N-methyl-4-(3-methylphenoxy)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-amine

V020-9382 Screening compound: N-benzyl-6-(2,4-difluorobenzoyl)-N-methyl-4-(3-methylphenoxy)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-amine
V020-9382 Screening compound: N-benzyl-6-(2,4-difluorobenzoyl)-N-methyl-4-(3-methylphenoxy)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-9382
N-benzyl-6-(2,4-difluorobenzoyl)-N-methyl-4-(3-methylphenoxy)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-amine

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

V020-9382

Molecular Formula

C29H26F2N4O2 (C29 H26 F2 N4 O2)

Compound Name

N-benzyl-6-(2,4-difluorobenzoyl)-N-methyl-4-(3-methylphenoxy)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-amine

IUPAC name

N-benzyl-6-(24-difluorobenzoyl)-N-methyl-4-(3-methylphenoxy)-5H6H7H8H-pyrido[43-d]pyrimidin-2-amine

SMILES

Cc1cccc(Oc2c(CN(CC3)C(c(ccc(F)c4)c4F)=O)c3nc(N(C)Cc3ccccc3)n2)c1

InChI

InChI=1S/C29H26F2N4O2/c1-19-7-6-10-22(15-19)37-27-24-18-35(28(36)23-12-11-21(30)16-25(23)31)14-13-26(24)32-29(33-27)34(2)17-20-8-4-3-5-9-20/h3-12,15-16H,13-14,17-18H2,1-2H3

InChI Key

KJCIKHNEHFPTHX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19934167

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

500.55

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.358

Distribution Coefficient, logD

6.358

Water Solubility, LogSw

-5.66

Polar Surface Area

46.008

Acid Dissociation Constant (pKa)

19.59

Base Dissociation Constant (pKb)

1.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.70

V020-9382 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with V020-9382 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-9382?
Check Price and Availability of V020-9382, 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 V020-9382 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-9382
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-9382
  • 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 V020-9382 available by request