V003-6062 Screening compound: 5-({[1-(3-fluorophenyl)-2-(2-methylpropanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-methyl-N-(propan-2-yl)furan-2-carboxamide

V003-6062 Screening compound: 5-({[1-(3-fluorophenyl)-2-(2-methylpropanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-methyl-N-(propan-2-yl)furan-2-carboxamide
V003-6062 Screening compound: 5-({[1-(3-fluorophenyl)-2-(2-methylpropanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-methyl-N-(propan-2-yl)furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-6062
5-({[1-(3-fluorophenyl)-2-(2-methylpropanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-methyl-N-(propan-2-yl)furan-2-carboxamide

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

V003-6062

Molecular Formula

C29H33FN2O4 (C29 H33 FN2 O4)

Compound Name

5-({[1-(3-fluorophenyl)-2-(2-methylpropanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-methyl-N-(propan-2-yl)furan-2-carboxamide

IUPAC name

n/a

SMILES

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

InChI

InChI=1S/C29H33FN2O4/c1-18(2)28(33)32-14-13-20-9-10-23(16-25(20)27(32)21-7-6-8-22(30)15-21)35-17-24-11-12-26(36-24)29(34)31(5)19(3)4/h6-12,15-16,18-19,27H,13-14,17H2,1-5H3/t27-/m0/s1

InChI Key

LECQDGKENGRYHO-MHZLTWQESA-N

MDL Number (MFCD)

MFCD19917996

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

492.59

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.592

Distribution Coefficient, logD

5.592

Water Solubility, LogSw

-5.45

Polar Surface Area

47.175

Acid Dissociation Constant (pKa)

22.07

Base Dissociation Constant (pKb)

-0.24

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.90

References: we are preparing a list of scientific research reports with V003-6062 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-6062?
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What is the minimum amount of V003-6062 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-6062
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-6062
  • 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 V003-6062 available by request