V010-2787 Screening compound: 2-[3,5-bis(trifluoromethyl)benzoyl]-1-(2-chlorophenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline

V010-2787 Screening compound: 2-[3,5-bis(trifluoromethyl)benzoyl]-1-(2-chlorophenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
V010-2787 Screening compound: 2-[3,5-bis(trifluoromethyl)benzoyl]-1-(2-chlorophenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound V010-2787
2-[3,5-bis(trifluoromethyl)benzoyl]-1-(2-chlorophenyl)-6,7-dimethoxy-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

V010-2787

Molecular Formula

C26H20ClF6NO3 (C26 H20 ClF6 NO3)

Compound Name

2-[3,5-bis(trifluoromethyl)benzoyl]-1-(2-chlorophenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline

IUPAC name

2-[35-bis(trifluoromethyl)benzoyl]-1-(2-chlorophenyl)-67-dimethoxy-1234-tetrahydroisoquinoline

SMILES

COc1cc(CCN(C2c(cccc3)c3Cl)C(c3cc(C(F)(F)F)cc(C(F)(F)F)c3)=O)c2cc1OC

InChI

InChI=1S/C26H20ClF6NO3/c1-36-21-11-14-7-8-34(23(19(14)13-22(21)37-2)18-5-3-4-6-20(18)27)24(35)15-9-16(25(28,29)30)12-17(10-15)26(31,32)33/h3-6,9-13,23H,7-8H2,1-2H3/t23-/m0/s1

InChI Key

DZJYGPPNHVJCLE-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD19958048

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

543.89

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

6.505

Distribution Coefficient, logD

6.505

Water Solubility, LogSw

-6.24

Polar Surface Area

31.122

Acid Dissociation Constant (pKa)

21.38

Base Dissociation Constant (pKb)

-7.68

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.90

References: we are preparing a list of scientific research reports with V010-2787 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V010-2787?
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What is the minimum amount of V010-2787 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V010-2787
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V010-2787
  • 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 V010-2787 available by request