8013-0284 Screening compound: 2,2,4-trimethyl-4-phenyl-1-(thiophene-2-carbonyl)-1,2,3,4-tetrahydroquinoline

8013-0284 Screening compound: 2,2,4-trimethyl-4-phenyl-1-(thiophene-2-carbonyl)-1,2,3,4-tetrahydroquinoline
8013-0284 Screening compound: 2,2,4-trimethyl-4-phenyl-1-(thiophene-2-carbonyl)-1,2,3,4-tetrahydroquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound 8013-0284
2,2,4-trimethyl-4-phenyl-1-(thiophene-2-carbonyl)-1,2,3,4-tetrahydroquinoline

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

8013-0284

Molecular Formula

C23H23NOS (C23 H23 NOS)

Compound Name

2,2,4-trimethyl-4-phenyl-1-(thiophene-2-carbonyl)-1,2,3,4-tetrahydroquinoline

IUPAC name

224-trimethyl-4-phenyl-1-(thiophene-2-carbonyl)-1234-tetrahydroquinoline

SMILES

CC(C)(CC1(C)c2ccccc2)N(C(c2cccs2)=O)c2c1cccc2

InChI

InChI=1S/C23H23NOS/c1-22(2)16-23(3,17-10-5-4-6-11-17)18-12-7-8-13-19(18)24(22)21(25)20-14-9-15-26-20/h4-15H,16H2,1-3H3/t23-/m0/s1

InChI Key

PCEJHTQHSXLWMO-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD03147126

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.51

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.442

Distribution Coefficient, logD

5.442

Water Solubility, LogSw

-5.57

Polar Surface Area

15.071

Acid Dissociation Constant (pKa)

27.15

Base Dissociation Constant (pKb)

-0.23

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.10

8013-0284 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 8013-0284 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8013-0284?
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What is the minimum amount of 8013-0284 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8013-0284
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8013-0284
  • 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 8013-0284 available by request