C230-0285 Screening compound: 7-(3,4-dimethoxyphenyl)-2-methyl-4-(3-methylphenyl)-N-(4-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide

C230-0285 Screening compound: 7-(3,4-dimethoxyphenyl)-2-methyl-4-(3-methylphenyl)-N-(4-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
C230-0285 Screening compound: 7-(3,4-dimethoxyphenyl)-2-methyl-4-(3-methylphenyl)-N-(4-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C230-0285
7-(3,4-dimethoxyphenyl)-2-methyl-4-(3-methylphenyl)-N-(4-methylphenyl)-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

C230-0285

Molecular Formula

C33H34N2O4 (C33 H34 N2 O4)

Compound Name

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

IUPAC name

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

SMILES

Cc(cc1)ccc1NC(C(C1c2cc(C)ccc2)=C(C)NC(CC(C2)c(cc3)cc(OC)c3OC)=C1C2=O)=O

InChI

InChI=1S/C33H34N2O4/c1-19-9-12-25(13-10-19)35-33(37)30-21(3)34-26-16-24(22-11-14-28(38-4)29(18-22)39-5)17-27(36)32(26)31(30)23-8-6-7-20(2)15-23/h6-15,18,24,31,34H,16-17H2,1-5H3,(H,35,37)

InChI Key

RAVWFMTUVFNHAO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06193894

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

522.64

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.086

Distribution Coefficient, logD

3.952

Water Solubility, LogSw

-5.45

Polar Surface Area

62.002

Acid Dissociation Constant (pKa)

5.27

Base Dissociation Constant (pKb)

-0.39

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

27.30

C230-0285 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 C230-0285 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C230-0285?
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What is the minimum amount of C230-0285 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C230-0285
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C230-0285
  • 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 C230-0285 available by request