V031-1967 Screening compound: 5-(diethylamino)-2-({N-[(furan-2-yl)methyl]-2-methoxyacetamido}methyl)phenyl 3,4-dichlorobenzene-1-sulfonate

V031-1967 Screening compound: 5-(diethylamino)-2-({N-[(furan-2-yl)methyl]-2-methoxyacetamido}methyl)phenyl 3,4-dichlorobenzene-1-sulfonate
V031-1967 Screening compound: 5-(diethylamino)-2-({N-[(furan-2-yl)methyl]-2-methoxyacetamido}methyl)phenyl 3,4-dichlorobenzene-1-sulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound V031-1967
5-(diethylamino)-2-({N-[(furan-2-yl)methyl]-2-methoxyacetamido}methyl)phenyl 3,4-dichlorobenzene-1-sulfonate

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

V031-1967

Molecular Formula

C25H28Cl2N2O6S (C25 H28 Cl2 N2 O6 S)

Compound Name

5-(diethylamino)-2-({N-[(furan-2-yl)methyl]-2-methoxyacetamido}methyl)phenyl 3,4-dichlorobenzene-1-sulfonate

IUPAC name

5-(diethylamino)-2-({N-[(furan-2-yl)methyl]-2-methoxyacetamido}methyl)phenyl 34-dichlorobenzene-1-sulfonate

SMILES

CCN(CC)c1cc(OS(c(cc2)cc(Cl)c2Cl)(=O)=O)c(CN(Cc2ccco2)C(COC)=O)cc1

InChI

InChI=1S/C25H28Cl2N2O6S/c1-4-28(5-2)19-9-8-18(15-29(25(30)17-33-3)16-20-7-6-12-34-20)24(13-19)35-36(31,32)21-10-11-22(26)23(27)14-21/h6-14H,4-5,15-17H2,1-3H3

InChI Key

JLXHECOZFZWPJD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20499398

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

555.48

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.855

Distribution Coefficient, logD

4.844

Water Solubility, LogSw

-4.95

Polar Surface Area

70.679

Acid Dissociation Constant (pKa)

21.24

Base Dissociation Constant (pKb)

5.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.00

References: we are preparing a list of scientific research reports with V031-1967 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V031-1967?
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What is the minimum amount of V031-1967 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V031-1967
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V031-1967
  • 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 V031-1967 available by request