5174-4573 Screening compound: ethyl 7-chloro-4-[(2-methoxy-5-methylphenyl)amino]-8-methylquinoline-3-carboxylate

5174-4573 Screening compound: ethyl 7-chloro-4-[(2-methoxy-5-methylphenyl)amino]-8-methylquinoline-3-carboxylate
5174-4573 Screening compound: ethyl 7-chloro-4-[(2-methoxy-5-methylphenyl)amino]-8-methylquinoline-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 5174-4573
ethyl 7-chloro-4-[(2-methoxy-5-methylphenyl)amino]-8-methylquinoline-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

5174-4573

Molecular Formula

C21H21ClN2O3 (C21 H21 ClN2 O3)

Compound Name

ethyl 7-chloro-4-[(2-methoxy-5-methylphenyl)amino]-8-methylquinoline-3-carboxylate

IUPAC name

ethyl 7-chloro-4-[(2-methoxy-5-methylphenyl)amino]-8-methylquinoline-3-carboxylate

SMILES

CCOC(c1cnc(c(C)c(cc2)Cl)c2c1Nc(cc(C)cc1)c1OC)=O

InChI

InChI=1S/C21H21ClN2O3/c1-5-27-21(25)15-11-23-19-13(3)16(22)8-7-14(19)20(15)24-17-10-12(2)6-9-18(17)26-4/h6-11H,5H2,1-4H3,(H,23,24)

InChI Key

OFCUMBZLAVUCQD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02966569

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

384.86

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.536

Distribution Coefficient, logD

5.536

Water Solubility, LogSw

-5.99

Polar Surface Area

45.064

Acid Dissociation Constant (pKa)

12.20

Base Dissociation Constant (pKb)

3.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

5174-4573 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 5174-4573 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5174-4573?
Check Price and Availability of 5174-4573, 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 5174-4573 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5174-4573
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5174-4573
  • 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 5174-4573 available by request