V029-6710 Screening compound: 4-{[(ethylcarbamoyl)(2-methoxyethyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate

V029-6710 Screening compound: 4-{[(ethylcarbamoyl)(2-methoxyethyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate
V029-6710 Screening compound: 4-{[(ethylcarbamoyl)(2-methoxyethyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-6710
4-{[(ethylcarbamoyl)(2-methoxyethyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-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

V029-6710

Molecular Formula

C20H25ClN2O5S (C20 H25 ClN2 O5 S)

Compound Name

4-{[(ethylcarbamoyl)(2-methoxyethyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate

IUPAC name

4-{[(ethylcarbamoyl)(2-methoxyethyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate

SMILES

CCNC(N(CCOC)Cc(cc1)ccc1OS(c(c(C)ccc1)c1Cl)(=O)=O)=O

InChI

InChI=1S/C20H25ClN2O5S/c1-4-22-20(24)23(12-13-27-3)14-16-8-10-17(11-9-16)28-29(25,26)19-15(2)6-5-7-18(19)21/h5-11H,4,12-14H2,1-3H3,(H,22,24)

InChI Key

IKOZUWJXXWGEHE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20498944

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

440.95

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.125

Distribution Coefficient, logD

3.125

Water Solubility, LogSw

-3.49

Polar Surface Area

70.572

Acid Dissociation Constant (pKa)

16.86

Base Dissociation Constant (pKb)

1.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

References: we are preparing a list of scientific research reports with V029-6710 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-6710?
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What is the minimum amount of V029-6710 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-6710
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-6710
  • 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 V029-6710 available by request