F474-3658 Screening compound: methyl 8-chloro-4-{[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]amino}-2-oxo-1,2-dihydroquinoline-3-carboxylate

F474-3658 Screening compound: methyl 8-chloro-4-{[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]amino}-2-oxo-1,2-dihydroquinoline-3-carboxylate
F474-3658 Screening compound: methyl 8-chloro-4-{[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]amino}-2-oxo-1,2-dihydroquinoline-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound F474-3658
methyl 8-chloro-4-{[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]amino}-2-oxo-1,2-dihydroquinoline-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

F474-3658

Molecular Formula

C17H16ClN3O4 (C17 H16 ClN3 O4)

Compound Name

methyl 8-chloro-4-{[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]amino}-2-oxo-1,2-dihydroquinoline-3-carboxylate

IUPAC name

methyl 8-chloro-4-{[(35-dimethyl-12-oxazol-4-yl)methyl]amino}-2-oxo-12-dihydroquinoline-3-carboxylate

SMILES

Cc1noc(C)c1CNC(c1cccc(Cl)c1N1)=C(C(OC)=O)C1=O

InChI

InChI=1S/C17H16ClN3O4/c1-8-11(9(2)25-21-8)7-19-15-10-5-4-6-12(18)14(10)20-16(22)13(15)17(23)24-3/h4-6H,7H2,1-3H3,(H2,19,20,22)

InChI Key

SOMUWJUNXIDVRI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27132834

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.78

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.978

Distribution Coefficient, logD

1.934

Water Solubility, LogSw

-3.11

Polar Surface Area

76.510

Acid Dissociation Constant (pKa)

6.03

Base Dissociation Constant (pKb)

-0.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

F474-3658 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

SmartTM Library (51161 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with F474-3658 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F474-3658?
Check Price and Availability of F474-3658, 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 F474-3658 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F474-3658
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F474-3658
  • 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 F474-3658 available by request