V026-8992 Screening compound: 2-{[(4-methoxyphenyl)methyl]sulfanyl}-3,6-dimethyl-5-[(3-methylphenyl)methyl]-3,4-dihydropyrimidin-4-one

V026-8992 Screening compound: 2-{[(4-methoxyphenyl)methyl]sulfanyl}-3,6-dimethyl-5-[(3-methylphenyl)methyl]-3,4-dihydropyrimidin-4-one
V026-8992 Screening compound: 2-{[(4-methoxyphenyl)methyl]sulfanyl}-3,6-dimethyl-5-[(3-methylphenyl)methyl]-3,4-dihydropyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-8992
2-{[(4-methoxyphenyl)methyl]sulfanyl}-3,6-dimethyl-5-[(3-methylphenyl)methyl]-3,4-dihydropyrimidin-4-one

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

V026-8992

Molecular Formula

C22H24N2O2S (C22 H24 N2 O2 S)

Compound Name

2-{[(4-methoxyphenyl)methyl]sulfanyl}-3,6-dimethyl-5-[(3-methylphenyl)methyl]-3,4-dihydropyrimidin-4-one

IUPAC name

2-{[(4-methoxyphenyl)methyl]sulfanyl}-36-dimethyl-5-[(3-methylphenyl)methyl]-34-dihydropyrimidin-4-one

SMILES

Cc1cccc(CC(C(N2C)=O)=C(C)N=C2SCc(cc2)ccc2OC)c1

InChI

InChI=1S/C22H24N2O2S/c1-15-6-5-7-18(12-15)13-20-16(2)23-22(24(3)21(20)25)27-14-17-8-10-19(26-4)11-9-17/h5-12H,13-14H2,1-4H3

InChI Key

PVHXBCSFVNHXSQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19776378

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

380.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.294

Distribution Coefficient, logD

4.294

Water Solubility, LogSw

-4.46

Polar Surface Area

32.732

Acid Dissociation Constant (pKa)

27.73

Base Dissociation Constant (pKb)

0.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

V026-8992 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with V026-8992 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-8992?
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What is the minimum amount of V026-8992 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-8992
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-8992
  • 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 V026-8992 available by request