V026-5626 Screening compound: 4-({[4-(4-acetylpiperazin-1-yl)-6-ethylpyrimidin-2-yl]sulfanyl}methyl)-N-[2-(morpholin-4-yl)ethyl]benzamide

V026-5626 Screening compound: 4-({[4-(4-acetylpiperazin-1-yl)-6-ethylpyrimidin-2-yl]sulfanyl}methyl)-N-[2-(morpholin-4-yl)ethyl]benzamide
V026-5626 Screening compound: 4-({[4-(4-acetylpiperazin-1-yl)-6-ethylpyrimidin-2-yl]sulfanyl}methyl)-N-[2-(morpholin-4-yl)ethyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-5626
4-({[4-(4-acetylpiperazin-1-yl)-6-ethylpyrimidin-2-yl]sulfanyl}methyl)-N-[2-(morpholin-4-yl)ethyl]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

V026-5626

Molecular Formula

C26H36N6O3S (C26 H36 N6 O3 S)

Compound Name

4-({[4-(4-acetylpiperazin-1-yl)-6-ethylpyrimidin-2-yl]sulfanyl}methyl)-N-[2-(morpholin-4-yl)ethyl]benzamide

IUPAC name

4-({[4-(4-acetylpiperazin-1-yl)-6-ethylpyrimidin-2-yl]sulfanyl}methyl)-N-[2-(morpholin-4-yl)ethyl]benzamide

SMILES

CCc1nc(SCc(cc2)ccc2C(NCCN2CCOCC2)=O)nc(N(CC2)CCN2C(C)=O)c1

InChI

InChI=1S/C26H36N6O3S/c1-3-23-18-24(32-12-10-31(11-13-32)20(2)33)29-26(28-23)36-19-21-4-6-22(7-5-21)25(34)27-8-9-30-14-16-35-17-15-30/h4-7,18H,3,8-17,19H2,1-2H3,(H,27,34)

InChI Key

NZIVXXWOCDTAPV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19817703

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

512.68

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.347

Distribution Coefficient, logD

2.333

Water Solubility, LogSw

-2.70

Polar Surface Area

74.013

Acid Dissociation Constant (pKa)

12.39

Base Dissociation Constant (pKb)

5.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.80

References: we are preparing a list of scientific research reports with V026-5626 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-5626?
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What is the minimum amount of V026-5626 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-5626
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-5626
  • 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 V026-5626 available by request