V013-3847 Screening compound: N-[(4-methylphenyl)methyl]-N-[4-({[(oxolan-2-yl)methyl]carbamoyl}methyl)phenyl]furan-2-carboxamide

V013-3847 Screening compound: N-[(4-methylphenyl)methyl]-N-[4-({[(oxolan-2-yl)methyl]carbamoyl}methyl)phenyl]furan-2-carboxamide
V013-3847 Screening compound: N-[(4-methylphenyl)methyl]-N-[4-({[(oxolan-2-yl)methyl]carbamoyl}methyl)phenyl]furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V013-3847
N-[(4-methylphenyl)methyl]-N-[4-({[(oxolan-2-yl)methyl]carbamoyl}methyl)phenyl]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

V013-3847

Molecular Formula

C26H28N2O4 (C26 H28 N2 O4)

Compound Name

N-[(4-methylphenyl)methyl]-N-[4-({[(oxolan-2-yl)methyl]carbamoyl}methyl)phenyl]furan-2-carboxamide

IUPAC name

N-[(4-methylphenyl)methyl]-N-[4-({[(oxolan-2-yl)methyl]carbamoyl}methyl)phenyl]furan-2-carboxamide

SMILES

Cc1ccc(CN(C(c2ccco2)=O)c2ccc(CC(NCC3OCCC3)=O)cc2)cc1

InChI

InChI=1S/C26H28N2O4/c1-19-6-8-21(9-7-19)18-28(26(30)24-5-3-15-32-24)22-12-10-20(11-13-22)16-25(29)27-17-23-4-2-14-31-23/h3,5-13,15,23H,2,4,14,16-18H2,1H3,(H,27,29)/t23-/m1/s1

InChI Key

CXWUBONXPVPRDX-HSZRJFAPSA-N

MDL Number (MFCD)

MFCD19903660

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.244

Distribution Coefficient, logD

3.244

Water Solubility, LogSw

-3.25

Polar Surface Area

57.022

Acid Dissociation Constant (pKa)

13.77

Base Dissociation Constant (pKb)

-0.21

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.77

References: we are preparing a list of scientific research reports with V013-3847 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V013-3847?
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What is the minimum amount of V013-3847 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V013-3847
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V013-3847
  • 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 V013-3847 available by request