V022-5334 Screening compound: 1-(4-methylphenyl)-2-(thiophene-2-carbonyl)-1,2,3,4-tetrahydroisoquinoline

V022-5334 Screening compound: 1-(4-methylphenyl)-2-(thiophene-2-carbonyl)-1,2,3,4-tetrahydroisoquinoline
V022-5334 Screening compound: 1-(4-methylphenyl)-2-(thiophene-2-carbonyl)-1,2,3,4-tetrahydroisoquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-5334
1-(4-methylphenyl)-2-(thiophene-2-carbonyl)-1,2,3,4-tetrahydroisoquinoline

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

V022-5334

Molecular Formula

C21H19NOS (C21 H19 NOS)

Compound Name

1-(4-methylphenyl)-2-(thiophene-2-carbonyl)-1,2,3,4-tetrahydroisoquinoline

IUPAC name

1-(4-methylphenyl)-2-(thiophene-2-carbonyl)-1234-tetrahydroisoquinoline

SMILES

Cc1ccc(C(c2c(CC3)cccc2)N3C(c2cccs2)=O)cc1

InChI

InChI=1S/C21H19NOS/c1-15-8-10-17(11-9-15)20-18-6-3-2-5-16(18)12-13-22(20)21(23)19-7-4-14-24-19/h2-11,14,20H,12-13H2,1H3/t20-/m0/s1

InChI Key

YTLPAZXAPYLUEC-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD19957692

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

333.45

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

5.424

Distribution Coefficient, logD

5.424

Water Solubility, LogSw

-5.40

Polar Surface Area

16.880

Acid Dissociation Constant (pKa)

22.21

Base Dissociation Constant (pKb)

-4.42

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

19.00

V022-5334 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

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

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system
Agro:
  • Agro
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with V022-5334 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-5334?
Check Price and Availability of V022-5334, 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 V022-5334 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-5334
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-5334
  • 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 V022-5334 available by request