V004-1582 Screening compound: 5-({[1-(4-methylphenyl)-2-propanoyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(oxolan-2-yl)methyl]furan-2-carboxamide

V004-1582 Screening compound: 5-({[1-(4-methylphenyl)-2-propanoyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(oxolan-2-yl)methyl]furan-2-carboxamide
V004-1582 Screening compound: 5-({[1-(4-methylphenyl)-2-propanoyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(oxolan-2-yl)methyl]furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-1582
5-({[1-(4-methylphenyl)-2-propanoyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(oxolan-2-yl)methyl]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

V004-1582

Molecular Formula

C30H34N2O5 (C30 H34 N2 O5)

Compound Name

5-({[1-(4-methylphenyl)-2-propanoyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(oxolan-2-yl)methyl]furan-2-carboxamide

IUPAC name

5-({[1-(4-methylphenyl)-2-propanoyl-1234-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(oxolan-2-yl)methyl]furan-2-carboxamide

SMILES

CCC(N(CC1)C(c2ccc(C)cc2)c2c1ccc(OCc1ccc(C(NCC3OCCC3)=O)o1)c2)=O

InChI

InChI=1S/C30H34N2O5/c1-3-28(33)32-15-14-21-10-11-23(17-26(21)29(32)22-8-6-20(2)7-9-22)36-19-25-12-13-27(37-25)30(34)31-18-24-5-4-16-35-24/h6-13,17,24,29H,3-5,14-16,18-19H2,1-2H3,(H,31,34)

InChI Key

JJSFXZQKAMUYOR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19917560

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

502.61

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.688

Distribution Coefficient, logD

4.688

Water Solubility, LogSw

-4.34

Polar Surface Area

63.742

Acid Dissociation Constant (pKa)

13.52

Base Dissociation Constant (pKb)

-1.61

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

40.00

References: we are preparing a list of scientific research reports with V004-1582 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-1582?
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What is the minimum amount of V004-1582 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-1582
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-1582
  • 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 V004-1582 available by request