V021-4924 Screening compound: N-(2-{4-[6-(2,4-dimethoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-4-fluoro-N-[(4-fluorophenyl)methyl]benzamide

V021-4924 Screening compound: N-(2-{4-[6-(2,4-dimethoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-4-fluoro-N-[(4-fluorophenyl)methyl]benzamide
V021-4924 Screening compound: N-(2-{4-[6-(2,4-dimethoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-4-fluoro-N-[(4-fluorophenyl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-4924
N-(2-{4-[6-(2,4-dimethoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-4-fluoro-N-[(4-fluorophenyl)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

V021-4924

Molecular Formula

C32H31F2N5O4 (C32 H31 F2 N5 O4)

Compound Name

N-(2-{4-[6-(2,4-dimethoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-4-fluoro-N-[(4-fluorophenyl)methyl]benzamide

IUPAC name

N-(2-{4-[6-(24-dimethoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-4-fluoro-N-[(4-fluorophenyl)methyl]benzamide

SMILES

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

InChI

InChI=1S/C32H31F2N5O4/c1-42-26-11-12-27(29(19-26)43-2)28-13-14-30(36-35-28)37-15-17-38(18-16-37)31(40)21-39(20-22-3-7-24(33)8-4-22)32(41)23-5-9-25(34)10-6-23/h3-14,19H,15-18,20-21H2,1-2H3

InChI Key

GVFZXWHNKIIWOP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19831740

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

587.63

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.884

Distribution Coefficient, logD

3.881

Water Solubility, LogSw

-3.98

Polar Surface Area

71.940

Acid Dissociation Constant (pKa)

22.66

Base Dissociation Constant (pKb)

7.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

V021-4924 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V021-4924 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-4924?
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What is the minimum amount of V021-4924 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-4924
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-4924
  • 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 V021-4924 available by request