L480-0113 Screening compound: methyl 4-{[4-(benzyloxy)phenyl]amino}-6-methylquinoline-2-carboxylate

L480-0113 Screening compound: methyl 4-{[4-(benzyloxy)phenyl]amino}-6-methylquinoline-2-carboxylate
L480-0113 Screening compound: methyl 4-{[4-(benzyloxy)phenyl]amino}-6-methylquinoline-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound L480-0113
methyl 4-{[4-(benzyloxy)phenyl]amino}-6-methylquinoline-2-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

L480-0113

Molecular Formula

C25H22N2O3 (C25 H22 N2 O3)

Compound Name

methyl 4-{[4-(benzyloxy)phenyl]amino}-6-methylquinoline-2-carboxylate

IUPAC name

methyl 4-{[4-(benzyloxy)phenyl]amino}-6-methylquinoline-2-carboxylate

SMILES

Cc(cc1c(Nc(cc2)ccc2OCc2ccccc2)c2)ccc1nc2C(OC)=O

InChI

InChI=1S/C25H22N2O3/c1-17-8-13-22-21(14-17)23(15-24(27-22)25(28)29-2)26-19-9-11-20(12-10-19)30-16-18-6-4-3-5-7-18/h3-15H,16H2,1-2H3,(H,26,27)

InChI Key

OLXVMBGBUBFUIB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27455830

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.214

Distribution Coefficient, logD

6.214

Water Solubility, LogSw

-5.59

Polar Surface Area

45.185

Acid Dissociation Constant (pKa)

18.26

Base Dissociation Constant (pKb)

4.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.00

L480-0113 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with L480-0113 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L480-0113?
Check Price and Availability of L480-0113, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of L480-0113 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L480-0113
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L480-0113
  • 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 L480-0113 available by request