V029-8483 Screening compound: 2-methoxy-5-{[2-methyl-N-(propan-2-yl)propanamido]methyl}phenyl 3,4-dichlorobenzene-1-sulfonate

V029-8483 Screening compound: 2-methoxy-5-{[2-methyl-N-(propan-2-yl)propanamido]methyl}phenyl 3,4-dichlorobenzene-1-sulfonate
V029-8483 Screening compound: 2-methoxy-5-{[2-methyl-N-(propan-2-yl)propanamido]methyl}phenyl 3,4-dichlorobenzene-1-sulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-8483
2-methoxy-5-{[2-methyl-N-(propan-2-yl)propanamido]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

V029-8483

Molecular Formula

C21H25Cl2NO5S (C21 H25 Cl2 NO5 S)

Compound Name

2-methoxy-5-{[2-methyl-N-(propan-2-yl)propanamido]methyl}phenyl 3,4-dichlorobenzene-1-sulfonate

IUPAC name

2-methoxy-5-{[2-methyl-N-(propan-2-yl)propanamido]methyl}phenyl 34-dichlorobenzene-1-sulfonate

SMILES

CC(C)C(N(Cc(cc1)cc(OS(c(cc2)cc(Cl)c2Cl)(=O)=O)c1OC)C(C)C)=O

InChI

InChI=1S/C21H25Cl2NO5S/c1-13(2)21(25)24(14(3)4)12-15-6-9-19(28-5)20(10-15)29-30(26,27)16-7-8-17(22)18(23)11-16/h6-11,13-14H,12H2,1-5H3

InChI Key

UFGCHTRFCDQSJC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20498749

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.4

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.869

Distribution Coefficient, logD

4.869

Water Solubility, LogSw

-4.93

Polar Surface Area

59.943

Acid Dissociation Constant (pKa)

22.91

Base Dissociation Constant (pKb)

-0.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

V029-8483 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with V029-8483 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-8483?
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What is the minimum amount of V029-8483 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-8483
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-8483
  • 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 V029-8483 available by request