V018-9539 Screening compound: 2-cyclopropanecarbonyl-6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinoline

V018-9539 Screening compound: 2-cyclopropanecarbonyl-6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinoline
V018-9539 Screening compound: 2-cyclopropanecarbonyl-6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-9539
2-cyclopropanecarbonyl-6,7-dimethoxy-1-phenyl-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

V018-9539

Molecular Formula

C21H23NO3 (C21 H23 NO3)

Compound Name

2-cyclopropanecarbonyl-6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinoline

IUPAC name

2-cyclopropanecarbonyl-67-dimethoxy-1-phenyl-1234-tetrahydroisoquinoline

SMILES

COc1cc(CCN(C2c3ccccc3)C(C3CC3)=O)c2cc1OC

InChI

InChI=1S/C21H23NO3/c1-24-18-12-16-10-11-22(21(23)15-8-9-15)20(14-6-4-3-5-7-14)17(16)13-19(18)25-2/h3-7,12-13,15,20H,8-11H2,1-2H3/t20-/m0/s1

InChI Key

RRISKAXABHAAIX-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD10530327

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

337.42

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.439

Distribution Coefficient, logD

3.439

Water Solubility, LogSw

-3.63

Polar Surface Area

31.645

Acid Dissociation Constant (pKa)

22.07

Base Dissociation Constant (pKb)

-2.26

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.10

References: we are preparing a list of scientific research reports with V018-9539 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-9539?
Check Price and Availability of V018-9539, 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 V018-9539 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-9539
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-9539
  • 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 V018-9539 available by request