C230-0171 Screening compound: 7-(3,4-dimethoxyphenyl)-4-(3-ethoxyphenyl)-N-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide

C230-0171 Screening compound: 7-(3,4-dimethoxyphenyl)-4-(3-ethoxyphenyl)-N-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
C230-0171 Screening compound: 7-(3,4-dimethoxyphenyl)-4-(3-ethoxyphenyl)-N-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C230-0171
7-(3,4-dimethoxyphenyl)-4-(3-ethoxyphenyl)-N-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-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

C230-0171

Molecular Formula

C34H36N2O6 (C34 H36 N2 O6)

Compound Name

7-(3,4-dimethoxyphenyl)-4-(3-ethoxyphenyl)-N-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide

IUPAC name

7-(34-dimethoxyphenyl)-4-(3-ethoxyphenyl)-N-(4-methoxyphenyl)-2-methyl-5-oxo-145678-hexahydroquinoline-3-carboxamide

SMILES

CCOc1cccc(C2C(C(CC(C3)c(cc4)cc(OC)c4OC)=O)=C3NC(C)=C2C(Nc(cc2)ccc2OC)=O)c1

InChI

InChI=1S/C34H36N2O6/c1-6-42-26-9-7-8-22(16-26)32-31(34(38)36-24-11-13-25(39-3)14-12-24)20(2)35-27-17-23(18-28(37)33(27)32)21-10-15-29(40-4)30(19-21)41-5/h7-16,19,23,32,35H,6,17-18H2,1-5H3,(H,36,38)

InChI Key

UAZVHYCTMQAWEM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06193875

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

568.67

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.515

Distribution Coefficient, logD

3.381

Water Solubility, LogSw

-5.46

Polar Surface Area

76.669

Acid Dissociation Constant (pKa)

5.27

Base Dissociation Constant (pKb)

1.70

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

29.40

C230-0171 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 C230-0171 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C230-0171?
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What is the minimum amount of C230-0171 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C230-0171
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C230-0171
  • 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 C230-0171 available by request