V024-5243 Screening compound: 4-[({4-[cyclohexyl(methyl)amino]-6-ethylpyrimidin-2-yl}sulfanyl)methyl]-N-[(pyridin-3-yl)methyl]benzamide

V024-5243 Screening compound: 4-[({4-[cyclohexyl(methyl)amino]-6-ethylpyrimidin-2-yl}sulfanyl)methyl]-N-[(pyridin-3-yl)methyl]benzamide
V024-5243 Screening compound: 4-[({4-[cyclohexyl(methyl)amino]-6-ethylpyrimidin-2-yl}sulfanyl)methyl]-N-[(pyridin-3-yl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V024-5243
4-[({4-[cyclohexyl(methyl)amino]-6-ethylpyrimidin-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

V024-5243

Molecular Formula

C27H33N5OS (C27 H33 N5 OS)

Compound Name

4-[({4-[cyclohexyl(methyl)amino]-6-ethylpyrimidin-2-yl}sulfanyl)methyl]-N-[(pyridin-3-yl)methyl]benzamide

IUPAC name

4-[({4-[cyclohexyl(methyl)amino]-6-ethylpyrimidin-2-yl}sulfanyl)methyl]-N-[(pyridin-3-yl)methyl]benzamide

SMILES

CCc1nc(SCc(cc2)ccc2C(NCc2cnccc2)=O)nc(N(C)C2CCCCC2)c1

InChI

InChI=1S/C27H33N5OS/c1-3-23-16-25(32(2)24-9-5-4-6-10-24)31-27(30-23)34-19-20-11-13-22(14-12-20)26(33)29-18-21-8-7-15-28-17-21/h7-8,11-17,24H,3-6,9-10,18-19H2,1-2H3,(H,29,33)

InChI Key

GIRCSNFFXRODRO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19817863

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

475.66

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.831

Distribution Coefficient, logD

4.830

Water Solubility, LogSw

-4.31

Polar Surface Area

53.156

Acid Dissociation Constant (pKa)

12.39

Base Dissociation Constant (pKb)

4.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.70

V024-5243 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

GPCR Targeted Library (31838 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V024-5243 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V024-5243?
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What is the minimum amount of V024-5243 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V024-5243
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V024-5243
  • 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 V024-5243 available by request