V009-9338 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[N-(3-ethoxypropyl)4-chlorobenzenesulfonamido]-N-[(3-methylthiophen-2-yl)methyl]acetamide

V009-9338 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[N-(3-ethoxypropyl)4-chlorobenzenesulfonamido]-N-[(3-methylthiophen-2-yl)methyl]acetamide
V009-9338 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[N-(3-ethoxypropyl)4-chlorobenzenesulfonamido]-N-[(3-methylthiophen-2-yl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V009-9338
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[N-(3-ethoxypropyl)4-chlorobenzenesulfonamido]-N-[(3-methylthiophen-2-yl)methyl]acetamide

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

V009-9338

Molecular Formula

C27H31ClN2O6S2 (C27 H31 ClN2 O6 S2)

Compound Name

N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[N-(3-ethoxypropyl)4-chlorobenzenesulfonamido]-N-[(3-methylthiophen-2-yl)methyl]acetamide

IUPAC name

N-[(2H-13-benzodioxol-5-yl)methyl]-2-[N-(3-ethoxypropyl)4-chlorobenzenesulfonamido]-N-[(3-methylthiophen-2-yl)methyl]acetamide

SMILES

CCOCCCN(CC(N(Cc1c(C)ccs1)Cc(cc1)cc2c1OCO2)=O)S(c(cc1)ccc1Cl)(=O)=O

InChI

InChI=1S/C27H31ClN2O6S2/c1-3-34-13-4-12-30(38(32,33)23-8-6-22(28)7-9-23)18-27(31)29(17-26-20(2)11-14-37-26)16-21-5-10-24-25(15-21)36-19-35-24/h5-11,14-15H,3-4,12-13,16-19H2,1-2H3

InChI Key

QQIYMHBUSULADE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19769065

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

579.14

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.005

Distribution Coefficient, logD

5.005

Water Solubility, LogSw

-5.05

Polar Surface Area

73.387

Acid Dissociation Constant (pKa)

21.86

Base Dissociation Constant (pKb)

-3.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.00

V009-9338 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer

References: we are preparing a list of scientific research reports with V009-9338 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V009-9338?
Check Price and Availability of V009-9338, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V009-9338 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V009-9338
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V009-9338
  • 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 V009-9338 available by request