V007-0084 Screening compound: 3-{[5-(3,5-dimethylphenoxy)-3-oxo-2-phenyl-2,3-dihydropyridazin-4-yl]amino}-N-[(pyridin-2-yl)methyl]benzamide

V007-0084 Screening compound: 3-{[5-(3,5-dimethylphenoxy)-3-oxo-2-phenyl-2,3-dihydropyridazin-4-yl]amino}-N-[(pyridin-2-yl)methyl]benzamide
V007-0084 Screening compound: 3-{[5-(3,5-dimethylphenoxy)-3-oxo-2-phenyl-2,3-dihydropyridazin-4-yl]amino}-N-[(pyridin-2-yl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-0084
3-{[5-(3,5-dimethylphenoxy)-3-oxo-2-phenyl-2,3-dihydropyridazin-4-yl]amino}-N-[(pyridin-2-yl)methyl]benzamide

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

V007-0084

Molecular Formula

C31H27N5O3 (C31 H27 N5 O3)

Compound Name

3-{[5-(3,5-dimethylphenoxy)-3-oxo-2-phenyl-2,3-dihydropyridazin-4-yl]amino}-N-[(pyridin-2-yl)methyl]benzamide

IUPAC name

3-{[5-(35-dimethylphenoxy)-3-oxo-2-phenyl-23-dihydropyridazin-4-yl]amino}-N-[(pyridin-2-yl)methyl]benzamide

SMILES

Cc1cc(OC(C=NN(c2ccccc2)C2=O)=C2Nc2cc(C(NCc3ncccc3)=O)ccc2)cc(C)c1

InChI

InChI=1S/C31H27N5O3/c1-21-15-22(2)17-27(16-21)39-28-20-34-36(26-12-4-3-5-13-26)31(38)29(28)35-24-11-8-9-23(18-24)30(37)33-19-25-10-6-7-14-32-25/h3-18,20,35H,19H2,1-2H3,(H,33,37)

InChI Key

HQUORBHWUOZDBU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19828089

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

517.59

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.989

Distribution Coefficient, logD

4.959

Water Solubility, LogSw

-4.63

Polar Surface Area

77.273

Acid Dissociation Constant (pKa)

11.18

Base Dissociation Constant (pKb)

6.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.70

V007-0084 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 V007-0084 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-0084?
Check Price and Availability of V007-0084, 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 V007-0084 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-0084
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-0084
  • 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 V007-0084 available by request