4593-2972 Screening compound: ethyl 4-[(2-ethylphenyl)amino]-2-methylquinoline-6-carboxylate

4593-2972 Screening compound: ethyl 4-[(2-ethylphenyl)amino]-2-methylquinoline-6-carboxylate
4593-2972 Screening compound: ethyl 4-[(2-ethylphenyl)amino]-2-methylquinoline-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4593-2972
ethyl 4-[(2-ethylphenyl)amino]-2-methylquinoline-6-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

4593-2972

Molecular Formula

C21H22N2O2 (C21 H22 N2 O2)

Compound Name

ethyl 4-[(2-ethylphenyl)amino]-2-methylquinoline-6-carboxylate

IUPAC name

ethyl 4-[(2-ethylphenyl)amino]-2-methylquinoline-6-carboxylate

SMILES

CCc(cccc1)c1Nc1c(cc(cc2)C(OCC)=O)c2nc(C)c1

InChI

InChI=1S/C21H22N2O2/c1-4-15-8-6-7-9-18(15)23-20-12-14(3)22-19-11-10-16(13-17(19)20)21(24)25-5-2/h6-13H,4-5H2,1-3H3,(H,22,23)

InChI Key

DMMUCVATSOOFNR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08052404

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

334.42

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.835

Distribution Coefficient, logD

5.807

Water Solubility, LogSw

-5.57

Polar Surface Area

36.646

Acid Dissociation Constant (pKa)

19.12

Base Dissociation Constant (pKb)

6.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

References: we are preparing a list of scientific research reports with 4593-2972 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4593-2972?
Check Price and Availability of 4593-2972, 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 4593-2972 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4593-2972
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4593-2972
  • 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 4593-2972 available by request