3360-9255 Screening compound: methyl 2-[2-(3-ethoxyphenyl)quinoline-4-amido]-5-methylthiophene-3-carboxylate

3360-9255 Screening compound: methyl 2-[2-(3-ethoxyphenyl)quinoline-4-amido]-5-methylthiophene-3-carboxylate
3360-9255 Screening compound: methyl 2-[2-(3-ethoxyphenyl)quinoline-4-amido]-5-methylthiophene-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3360-9255
methyl 2-[2-(3-ethoxyphenyl)quinoline-4-amido]-5-methylthiophene-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

3360-9255

Molecular Formula

C25H22N2O4S (C25 H22 N2 O4 S)

Compound Name

methyl 2-[2-(3-ethoxyphenyl)quinoline-4-amido]-5-methylthiophene-3-carboxylate

IUPAC name

methyl 2-[2-(3-ethoxyphenyl)quinoline-4-amido]-5-methylthiophene-3-carboxylate

SMILES

CCOc1cccc(-c2nc3ccccc3c(C(Nc(sc(C)c3)c3C(OC)=O)=O)c2)c1

InChI

InChI=1S/C25H22N2O4S/c1-4-31-17-9-7-8-16(13-17)22-14-19(18-10-5-6-11-21(18)26-22)23(28)27-24-20(25(29)30-3)12-15(2)32-24/h5-14H,4H2,1-3H3,(H,27,28)

InChI Key

MPCOXUXSAPRUHZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01922618

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.53

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.075

Distribution Coefficient, logD

5.124

Water Solubility, LogSw

-5.69

Polar Surface Area

59.481

Acid Dissociation Constant (pKa)

6.50

Base Dissociation Constant (pKb)

3.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.00

3360-9255 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with 3360-9255 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3360-9255?
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What is the minimum amount of 3360-9255 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3360-9255
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3360-9255
  • 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 3360-9255 available by request