V003-7984 Screening compound: 5-({[2-(2,2-dimethylpropanoyl)-1-(3-fluorophenyl)-1,2,3,4-tetrahydro-7-isoquinolinyl]oxy}methyl)-N~2~-(2-furylmethyl)-N~2~-methyl-2-furamide

V003-7984 Screening compound: 5-({[2-(2,2-dimethylpropanoyl)-1-(3-fluorophenyl)-1,2,3,4-tetrahydro-7-isoquinolinyl]oxy}methyl)-N~2~-(2-furylmethyl)-N~2~-methyl-2-furamide
V003-7984 Screening compound: 5-({[2-(2,2-dimethylpropanoyl)-1-(3-fluorophenyl)-1,2,3,4-tetrahydro-7-isoquinolinyl]oxy}methyl)-N~2~-(2-furylmethyl)-N~2~-methyl-2-furamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-7984
5-({[2-(2,2-dimethylpropanoyl)-1-(3-fluorophenyl)-1,2,3,4-tetrahydro-7-isoquinolinyl]oxy}methyl)-N~2~-(2-furylmethyl)-N~2~-methyl-2-furamide

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

V003-7984

Molecular Formula

C32H33FN2O5 (C32 H33 FN2 O5)

Compound Name

5-({[2-(2,2-dimethylpropanoyl)-1-(3-fluorophenyl)-1,2,3,4-tetrahydro-7-isoquinolinyl]oxy}methyl)-N~2~-(2-furylmethyl)-N~2~-methyl-2-furamide

IUPAC name

5-({[2-(22-dimethylpropanoyl)-1-(3-fluorophenyl)-1234-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(furan-2-yl)methyl]-N-methylfuran-2-carboxamide

SMILES

CC(C)(C)C(N(CC1)C(c2cccc(F)c2)c2c1ccc(OCc1ccc(C(N(C)Cc3ccco3)=O)o1)c2)=O

InChI

InChI=1S/C32H33FN2O5/c1-32(2,3)31(37)35-15-14-21-10-11-24(18-27(21)29(35)22-7-5-8-23(33)17-22)39-20-26-12-13-28(40-26)30(36)34(4)19-25-9-6-16-38-25/h5-13,16-18,29H,14-15,19-20H2,1-4H3/t29-/m0/s1

InChI Key

IHAQKDKLWHCDHN-LJAQVGFWSA-N

MDL Number (MFCD)

MFCD19918036

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

544.62

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.182

Distribution Coefficient, logD

6.182

Water Solubility, LogSw

-5.54

Polar Surface Area

55.101

Acid Dissociation Constant (pKa)

23.73

Base Dissociation Constant (pKb)

-3.23

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.25

References: we are preparing a list of scientific research reports with V003-7984 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-7984?
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What is the minimum amount of V003-7984 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-7984
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-7984
  • 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 V003-7984 available by request