3365-4121 Screening compound: propan-2-yl 2-[2-(4-methoxyphenyl)quinoline-4-amido]-4,5-dimethylthiophene-3-carboxylate

3365-4121 Screening compound: propan-2-yl 2-[2-(4-methoxyphenyl)quinoline-4-amido]-4,5-dimethylthiophene-3-carboxylate
3365-4121 Screening compound: propan-2-yl 2-[2-(4-methoxyphenyl)quinoline-4-amido]-4,5-dimethylthiophene-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3365-4121
propan-2-yl 2-[2-(4-methoxyphenyl)quinoline-4-amido]-4,5-dimethylthiophene-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

3365-4121

Molecular Formula

C27H26N2O4S (C27 H26 N2 O4 S)

Compound Name

propan-2-yl 2-[2-(4-methoxyphenyl)quinoline-4-amido]-4,5-dimethylthiophene-3-carboxylate

IUPAC name

propan-2-yl 2-[2-(4-methoxyphenyl)quinoline-4-amido]-45-dimethylthiophene-3-carboxylate

SMILES

CC(C)OC(c1c(NC(c2cc(-c(cc3)ccc3OC)nc3ccccc23)=O)sc(C)c1C)=O

InChI

InChI=1S/C27H26N2O4S/c1-15(2)33-27(31)24-16(3)17(4)34-26(24)29-25(30)21-14-23(18-10-12-19(32-5)13-11-18)28-22-9-7-6-8-20(21)22/h6-15H,1-5H3,(H,29,30)

InChI Key

IXKMCRGTRJBYFL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01351466

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.58

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

6.709

Distribution Coefficient, logD

4.729

Water Solubility, LogSw

-5.90

Polar Surface Area

59.160

Acid Dissociation Constant (pKa)

5.42

Base Dissociation Constant (pKb)

1.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

3365-4121 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer

References: we are preparing a list of scientific research reports with 3365-4121 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3365-4121?
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What is the minimum amount of 3365-4121 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3365-4121
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3365-4121
  • 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 3365-4121 available by request