C202-3071 Screening compound: N-(5-chloro-2-methylphenyl)-7-(furan-2-yl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide

C202-3071 Screening compound: N-(5-chloro-2-methylphenyl)-7-(furan-2-yl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
C202-3071 Screening compound: N-(5-chloro-2-methylphenyl)-7-(furan-2-yl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C202-3071
N-(5-chloro-2-methylphenyl)-7-(furan-2-yl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide

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

C202-3071

Molecular Formula

C21H17ClN2O4 (C21 H17 ClN2 O4)

Compound Name

N-(5-chloro-2-methylphenyl)-7-(furan-2-yl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide

IUPAC name

N-(5-chloro-2-methylphenyl)-7-(furan-2-yl)-25-dioxo-125678-hexahydroquinoline-3-carboxamide

SMILES

Cc(ccc(Cl)c1)c1NC(C1=CC(C(CC(C2)c3ccco3)=O)=C2NC1=O)=O

InChI

InChI=1S/C21H17ClN2O4/c1-11-4-5-13(22)9-16(11)23-20(26)15-10-14-17(24-21(15)27)7-12(8-18(14)25)19-3-2-6-28-19/h2-6,9-10,12H,7-8H2,1H3,(H,23,26)(H,24,27)/t12-/m0/s1

InChI Key

SRSVOETWBATXML-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD26963291

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

396.83

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.224

Distribution Coefficient, logD

-0.426

Water Solubility, LogSw

-3.35

Polar Surface Area

69.035

Acid Dissociation Constant (pKa)

3.75

Base Dissociation Constant (pKb)

-3.27

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

19.00

C202-3071 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C202-3071 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C202-3071?
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What is the minimum amount of C202-3071 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C202-3071
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C202-3071
  • 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 C202-3071 available by request