G198-0351 Screening compound: methyl 4-[(4-methylphenyl)methoxy]-2-{[(3-methylphenyl)methyl]sulfanyl}quinoline-3-carboxylate

G198-0351 Screening compound: methyl 4-[(4-methylphenyl)methoxy]-2-{[(3-methylphenyl)methyl]sulfanyl}quinoline-3-carboxylate
G198-0351 Screening compound: methyl 4-[(4-methylphenyl)methoxy]-2-{[(3-methylphenyl)methyl]sulfanyl}quinoline-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G198-0351
methyl 4-[(4-methylphenyl)methoxy]-2-{[(3-methylphenyl)methyl]sulfanyl}quinoline-3-carboxylate

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

G198-0351

Molecular Formula

C27H25NO3S (C27 H25 NO3 S)

Compound Name

methyl 4-[(4-methylphenyl)methoxy]-2-{[(3-methylphenyl)methyl]sulfanyl}quinoline-3-carboxylate

IUPAC name

methyl 4-[(4-methylphenyl)methoxy]-2-{[(3-methylphenyl)methyl]sulfanyl}quinoline-3-carboxylate

SMILES

Cc1ccc(COc2c(C(OC)=O)c(SCc3cc(C)ccc3)nc3ccccc23)cc1

InChI

InChI=1S/C27H25NO3S/c1-18-11-13-20(14-12-18)16-31-25-22-9-4-5-10-23(22)28-26(24(25)27(29)30-3)32-17-21-8-6-7-19(2)15-21/h4-15H,16-17H2,1-3H3

InChI Key

LMDHFKFWBLAPKT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14984286

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.57

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

7.291

Distribution Coefficient, logD

7.291

Water Solubility, LogSw

-5.94

Polar Surface Area

37.004

Acid Dissociation Constant (pKa)

25.77

Base Dissociation Constant (pKb)

-0.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.50

G198-0351 in Drug Discovery

Included in Screening Libraries

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G198-0351 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G198-0351?
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What is the minimum amount of G198-0351 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G198-0351
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G198-0351
  • 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 G198-0351 available by request