V007-4656 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-{4-[6-(2,4-dimethoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-4-fluorobenzamide

V007-4656 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-{4-[6-(2,4-dimethoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-4-fluorobenzamide
V007-4656 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-{4-[6-(2,4-dimethoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-4-fluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-4656
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-{4-[6-(2,4-dimethoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-4-fluorobenzamide

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

V007-4656

Molecular Formula

C33H32FN5O6 (C33 H32 FN5 O6)

Compound Name

N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-{4-[6-(2,4-dimethoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-4-fluorobenzamide

IUPAC name

N-[(2H-13-benzodioxol-5-yl)methyl]-N-(2-{4-[6-(24-dimethoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-4-fluorobenzamide

SMILES

COc(cc1)cc(OC)c1-c(cc1)nnc1N(CC1)CCN1C(CN(Cc(cc1)cc2c1OCO2)C(c(cc1)ccc1F)=O)=O

InChI

InChI=1S/C33H32FN5O6/c1-42-25-8-9-26(29(18-25)43-2)27-10-12-31(36-35-27)37-13-15-38(16-14-37)32(40)20-39(33(41)23-4-6-24(34)7-5-23)19-22-3-11-28-30(17-22)45-21-44-28/h3-12,17-18H,13-16,19-21H2,1-2H3

InChI Key

CXBCCALLPPUJRI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19832092

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

613.65

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

3.726

Distribution Coefficient, logD

3.723

Water Solubility, LogSw

-4.04

Polar Surface Area

89.055

Acid Dissociation Constant (pKa)

22.66

Base Dissociation Constant (pKb)

7.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

V007-4656 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 V007-4656 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-4656?
Check Price and Availability of V007-4656, 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 V007-4656 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-4656
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-4656
  • 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 V007-4656 available by request