V016-6088 Screening compound: 2-({2-[(3-methylphenyl)methyl]-1-phenyl-1,2,3,4-tetrahydroisoquinolin-7-yl}oxy)-N-(prop-2-en-1-yl)butanamide

V016-6088 Screening compound: 2-({2-[(3-methylphenyl)methyl]-1-phenyl-1,2,3,4-tetrahydroisoquinolin-7-yl}oxy)-N-(prop-2-en-1-yl)butanamide
V016-6088 Screening compound: 2-({2-[(3-methylphenyl)methyl]-1-phenyl-1,2,3,4-tetrahydroisoquinolin-7-yl}oxy)-N-(prop-2-en-1-yl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-6088
2-({2-[(3-methylphenyl)methyl]-1-phenyl-1,2,3,4-tetrahydroisoquinolin-7-yl}oxy)-N-(prop-2-en-1-yl)butanamide

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

V016-6088

Molecular Formula

C30H34N2O2 (C30 H34 N2 O2)

Compound Name

2-({2-[(3-methylphenyl)methyl]-1-phenyl-1,2,3,4-tetrahydroisoquinolin-7-yl}oxy)-N-(prop-2-en-1-yl)butanamide

IUPAC name

2-({2-[(3-methylphenyl)methyl]-1-phenyl-1234-tetrahydroisoquinolin-7-yl}oxy)-N-(prop-2-en-1-yl)butanamide

SMILES

CCC(C(NCC=C)=O)Oc1cc(C(c2ccccc2)N(Cc2cc(C)ccc2)CC2)c2cc1

InChI

InChI=1S/C30H34N2O2/c1-4-17-31-30(33)28(5-2)34-26-15-14-24-16-18-32(21-23-11-9-10-22(3)19-23)29(27(24)20-26)25-12-7-6-8-13-25/h4,6-15,19-20,28-29H,1,5,16-18,21H2,2-3H3,(H,31,33)

InChI Key

VLEBNTGUJFPQII-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19898407

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

454.61

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.333

Distribution Coefficient, logD

5.146

Water Solubility, LogSw

-5.52

Polar Surface Area

34.310

Acid Dissociation Constant (pKa)

13.38

Base Dissociation Constant (pKb)

8.56

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

30.00

References: we are preparing a list of scientific research reports with V016-6088 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-6088?
Check Price and Availability of V016-6088, 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 V016-6088 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-6088
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-6088
  • 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 V016-6088 available by request