C201-0361 Screening compound: methyl 2-(ethylsulfanyl)-4-{[2-methoxy-5-(methoxycarbonyl)phenyl]methoxy}quinoline-3-carboxylate

C201-0361 Screening compound: methyl 2-(ethylsulfanyl)-4-{[2-methoxy-5-(methoxycarbonyl)phenyl]methoxy}quinoline-3-carboxylate
C201-0361 Screening compound: methyl 2-(ethylsulfanyl)-4-{[2-methoxy-5-(methoxycarbonyl)phenyl]methoxy}quinoline-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C201-0361
methyl 2-(ethylsulfanyl)-4-{[2-methoxy-5-(methoxycarbonyl)phenyl]methoxy}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

C201-0361

Molecular Formula

C23H23NO6S (C23 H23 NO6 S)

Compound Name

methyl 2-(ethylsulfanyl)-4-{[2-methoxy-5-(methoxycarbonyl)phenyl]methoxy}quinoline-3-carboxylate

IUPAC name

methyl 2-(ethylsulfanyl)-4-{[2-methoxy-5-(methoxycarbonyl)phenyl]methoxy}quinoline-3-carboxylate

SMILES

CCSc1nc2ccccc2c(OCc(cc(cc2)C(OC)=O)c2OC)c1C(OC)=O

InChI

InChI=1S/C23H23NO6S/c1-5-31-21-19(23(26)29-4)20(16-8-6-7-9-17(16)24-21)30-13-15-12-14(22(25)28-3)10-11-18(15)27-2/h6-12H,5,13H2,1-4H3

InChI Key

OKQDMNYHGITXCU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14729367

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

441.5

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.179

Distribution Coefficient, logD

5.179

Water Solubility, LogSw

-5.44

Polar Surface Area

66.080

Acid Dissociation Constant (pKa)

27.24

Base Dissociation Constant (pKb)

0.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

C201-0361 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C201-0361 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C201-0361?
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What is the minimum amount of C201-0361 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C201-0361
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C201-0361
  • 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 C201-0361 available by request