V008-4862 Screening compound: 6,7-dimethoxy-1-phenyl-2-{5-[3-(trifluoromethyl)phenyl]thiophene-2-carbonyl}-1,2,3,4-tetrahydroisoquinoline

V008-4862 Screening compound: 6,7-dimethoxy-1-phenyl-2-{5-[3-(trifluoromethyl)phenyl]thiophene-2-carbonyl}-1,2,3,4-tetrahydroisoquinoline
V008-4862 Screening compound: 6,7-dimethoxy-1-phenyl-2-{5-[3-(trifluoromethyl)phenyl]thiophene-2-carbonyl}-1,2,3,4-tetrahydroisoquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-4862
6,7-dimethoxy-1-phenyl-2-{5-[3-(trifluoromethyl)phenyl]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

V008-4862

Molecular Formula

C29H24F3NO3S (C29 H24 F3 NO3 S)

Compound Name

6,7-dimethoxy-1-phenyl-2-{5-[3-(trifluoromethyl)phenyl]thiophene-2-carbonyl}-1,2,3,4-tetrahydroisoquinoline

IUPAC name

67-dimethoxy-1-phenyl-2-{5-[3-(trifluoromethyl)phenyl]thiophene-2-carbonyl}-1234-tetrahydroisoquinoline

SMILES

COc1cc(CCN(C2c3ccccc3)C(c3ccc(-c4cc(C(F)(F)F)ccc4)s3)=O)c2cc1OC

InChI

InChI=1S/C29H24F3NO3S/c1-35-23-16-19-13-14-33(27(18-7-4-3-5-8-18)22(19)17-24(23)36-2)28(34)26-12-11-25(37-26)20-9-6-10-21(15-20)29(30,31)32/h3-12,15-17,27H,13-14H2,1-2H3/t27-/m0/s1

InChI Key

WHRBGWSCYPJFJU-MHZLTWQESA-N

MDL Number (MFCD)

MFCD19958185

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

523.58

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

7.014

Distribution Coefficient, logD

7.014

Water Solubility, LogSw

-5.86

Polar Surface Area

31.869

Acid Dissociation Constant (pKa)

22.21

Base Dissociation Constant (pKb)

-5.55

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.70

References: we are preparing a list of scientific research reports with V008-4862 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-4862?
Check Price and Availability of V008-4862, 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 V008-4862 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-4862
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-4862
  • 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 V008-4862 available by request