V013-9759 Screening compound: 2-{4-[3-(naphthalen-1-yl)-1H-pyrazol-5-yl]benzoyl}-1,2,3,4-tetrahydroisoquinoline

V013-9759 Screening compound: 2-{4-[3-(naphthalen-1-yl)-1H-pyrazol-5-yl]benzoyl}-1,2,3,4-tetrahydroisoquinoline
V013-9759 Screening compound: 2-{4-[3-(naphthalen-1-yl)-1H-pyrazol-5-yl]benzoyl}-1,2,3,4-tetrahydroisoquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound V013-9759
2-{4-[3-(naphthalen-1-yl)-1H-pyrazol-5-yl]benzoyl}-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

V013-9759

Molecular Formula

C29H23N3O (C29 H23 N3 O)

Compound Name

2-{4-[3-(naphthalen-1-yl)-1H-pyrazol-5-yl]benzoyl}-1,2,3,4-tetrahydroisoquinoline

IUPAC name

2-{4-[3-(naphthalen-1-yl)-1H-pyrazol-5-yl]benzoyl}-1234-tetrahydroisoquinoline

SMILES

O=C(c(cc1)ccc1-c1cc(-c2cccc3ccccc23)n[nH]1)N(CC1)Cc2c1cccc2

InChI

InChI=1S/C29H23N3O/c33-29(32-17-16-20-6-1-2-8-24(20)19-32)23-14-12-22(13-15-23)27-18-28(31-30-27)26-11-5-9-21-7-3-4-10-25(21)26/h1-15,18H,16-17,19H2,(H,30,31)

InChI Key

XGUVWYWEGLTCDI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19954326

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

429.52

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.917

Distribution Coefficient, logD

5.917

Water Solubility, LogSw

-7.01

Polar Surface Area

38.495

Acid Dissociation Constant (pKa)

12.85

Base Dissociation Constant (pKb)

2.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.30

References: we are preparing a list of scientific research reports with V013-9759 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V013-9759?
Check Price and Availability of V013-9759, 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 V013-9759 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V013-9759
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V013-9759
  • 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 V013-9759 available by request