V024-9425 Screening compound: 4-({[4-(4-benzylpiperazin-1-yl)-6-(methoxymethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-[(pyridin-3-yl)methyl]benzamide

V024-9425 Screening compound: 4-({[4-(4-benzylpiperazin-1-yl)-6-(methoxymethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-[(pyridin-3-yl)methyl]benzamide
V024-9425 Screening compound: 4-({[4-(4-benzylpiperazin-1-yl)-6-(methoxymethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-[(pyridin-3-yl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V024-9425
4-({[4-(4-benzylpiperazin-1-yl)-6-(methoxymethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-[(pyridin-3-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

V024-9425

Molecular Formula

C31H34N6O2S (C31 H34 N6 O2 S)

Compound Name

4-({[4-(4-benzylpiperazin-1-yl)-6-(methoxymethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-[(pyridin-3-yl)methyl]benzamide

IUPAC name

4-({[4-(4-benzylpiperazin-1-yl)-6-(methoxymethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-[(pyridin-3-yl)methyl]benzamide

SMILES

COCc1nc(SCc(cc2)ccc2C(NCc2cnccc2)=O)nc(N2CCN(Cc3ccccc3)CC2)c1

InChI

InChI=1S/C31H34N6O2S/c1-39-22-28-18-29(37-16-14-36(15-17-37)21-24-6-3-2-4-7-24)35-31(34-28)40-23-25-9-11-27(12-10-25)30(38)33-20-26-8-5-13-32-19-26/h2-13,18-19H,14-17,20-23H2,1H3,(H,33,38)

InChI Key

REXPEUMIQCBFTC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19826773

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

554.72

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.901

Distribution Coefficient, logD

3.794

Water Solubility, LogSw

-3.79

Polar Surface Area

66.567

Acid Dissociation Constant (pKa)

12.39

Base Dissociation Constant (pKb)

6.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.00

References: we are preparing a list of scientific research reports with V024-9425 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V024-9425?
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What is the minimum amount of V024-9425 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V024-9425
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V024-9425
  • 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 V024-9425 available by request