L036-2143 Screening compound: ethyl 3-[2-(4-acetamidophenyl)-6-methylquinoline-4-amido]benzoate

L036-2143 Screening compound: ethyl 3-[2-(4-acetamidophenyl)-6-methylquinoline-4-amido]benzoate
L036-2143 Screening compound: ethyl 3-[2-(4-acetamidophenyl)-6-methylquinoline-4-amido]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound L036-2143
ethyl 3-[2-(4-acetamidophenyl)-6-methylquinoline-4-amido]benzoate

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

L036-2143

Molecular Formula

C28H25N3O4 (C28 H25 N3 O4)

Compound Name

ethyl 3-[2-(4-acetamidophenyl)-6-methylquinoline-4-amido]benzoate

IUPAC name

ethyl 3-[2-(4-acetamidophenyl)-6-methylquinoline-4-amido]benzoate

SMILES

CCOC(c1cc(NC(c2cc(-c(cc3)ccc3NC(C)=O)nc3ccc(C)cc23)=O)ccc1)=O

InChI

InChI=1S/C28H25N3O4/c1-4-35-28(34)20-6-5-7-22(15-20)30-27(33)24-16-26(31-25-13-8-17(2)14-23(24)25)19-9-11-21(12-10-19)29-18(3)32/h5-16H,4H2,1-3H3,(H,29,32)(H,30,33)

InChI Key

WNQKPYPDBVJBAF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15116627

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.140

Distribution Coefficient, logD

6.140

Water Solubility, LogSw

-5.53

Polar Surface Area

75.404

Acid Dissociation Constant (pKa)

13.00

Base Dissociation Constant (pKb)

2.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

L036-2143 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with L036-2143 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L036-2143?
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What is the minimum amount of L036-2143 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L036-2143
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L036-2143
  • 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 L036-2143 available by request