V022-8434 Screening compound: 2-{[2-cyclopropanecarbonyl-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-cyclopropylbutanamide

V022-8434 Screening compound: 2-{[2-cyclopropanecarbonyl-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-cyclopropylbutanamide
V022-8434 Screening compound: 2-{[2-cyclopropanecarbonyl-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-cyclopropylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-8434
2-{[2-cyclopropanecarbonyl-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-cyclopropylbutanamide

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

V022-8434

Molecular Formula

C27H32N2O3 (C27 H32 N2 O3)

Compound Name

2-{[2-cyclopropanecarbonyl-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-cyclopropylbutanamide

IUPAC name

2-{[2-cyclopropanecarbonyl-1-(4-methylphenyl)-1234-tetrahydroisoquinolin-7-yl]oxy}-N-cyclopropylbutanamide

SMILES

CCC(C(NC1CC1)=O)Oc1cc(C(c2ccc(C)cc2)N(CC2)C(C3CC3)=O)c2cc1

InChI

InChI=1S/C27H32N2O3/c1-3-24(26(30)28-21-11-12-21)32-22-13-10-18-14-15-29(27(31)20-8-9-20)25(23(18)16-22)19-6-4-17(2)5-7-19/h4-7,10,13,16,20-21,24-25H,3,8-9,11-12,14-15H2,1-2H3,(H,28,30)

InChI Key

LYKDMIXSELLWMZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19916355

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.56

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.163

Distribution Coefficient, logD

5.163

Water Solubility, LogSw

-5.02

Polar Surface Area

47.526

Acid Dissociation Constant (pKa)

13.35

Base Dissociation Constant (pKb)

-0.29

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

48.10

V022-8434 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Agro:
  • Agro

References: we are preparing a list of scientific research reports with V022-8434 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-8434?
Check Price and Availability of V022-8434, 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 V022-8434 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-8434
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-8434
  • 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 V022-8434 available by request