V025-7644 Screening compound: 3-[({4-[cyclohexyl(methyl)amino]-6-methylpyrimidin-2-yl}sulfanyl)methyl]-N-ethylbenzamide

V025-7644 Screening compound: 3-[({4-[cyclohexyl(methyl)amino]-6-methylpyrimidin-2-yl}sulfanyl)methyl]-N-ethylbenzamide
V025-7644 Screening compound: 3-[({4-[cyclohexyl(methyl)amino]-6-methylpyrimidin-2-yl}sulfanyl)methyl]-N-ethylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V025-7644
3-[({4-[cyclohexyl(methyl)amino]-6-methylpyrimidin-2-yl}sulfanyl)methyl]-N-ethylbenzamide

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

V025-7644

Molecular Formula

C22H30N4OS (C22 H30 N4 OS)

Compound Name

3-[({4-[cyclohexyl(methyl)amino]-6-methylpyrimidin-2-yl}sulfanyl)methyl]-N-ethylbenzamide

IUPAC name

3-[({4-[cyclohexyl(methyl)amino]-6-methylpyrimidin-2-yl}sulfanyl)methyl]-N-ethylbenzamide

SMILES

CCNC(c1cccc(CSc2nc(N(C)C3CCCCC3)cc(C)n2)c1)=O

InChI

InChI=1S/C22H30N4OS/c1-4-23-21(27)18-10-8-9-17(14-18)15-28-22-24-16(2)13-20(25-22)26(3)19-11-6-5-7-12-19/h8-10,13-14,19H,4-7,11-12,15H2,1-3H3,(H,23,27)

InChI Key

LBUBIOZACWCJOD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19815385

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

398.57

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.392

Distribution Coefficient, logD

4.392

Water Solubility, LogSw

-4.24

Polar Surface Area

42.847

Acid Dissociation Constant (pKa)

13.27

Base Dissociation Constant (pKb)

4.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

V025-7644 in Drug Discovery

Included in Screening Libraries

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with V025-7644 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V025-7644?
Check Price and Availability of V025-7644, 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 V025-7644 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V025-7644
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V025-7644
  • 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 V025-7644 available by request