V010-4443 Screening compound: N-(3,4-dimethoxyphenyl)-3-nitro-N-{[4-(trifluoromethyl)phenyl]methyl}benzene-1-sulfonamide

V010-4443 Screening compound: N-(3,4-dimethoxyphenyl)-3-nitro-N-{[4-(trifluoromethyl)phenyl]methyl}benzene-1-sulfonamide
V010-4443 Screening compound: N-(3,4-dimethoxyphenyl)-3-nitro-N-{[4-(trifluoromethyl)phenyl]methyl}benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V010-4443
N-(3,4-dimethoxyphenyl)-3-nitro-N-{[4-(trifluoromethyl)phenyl]methyl}benzene-1-sulfonamide

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

V010-4443

Molecular Formula

C22H19F3N2O6S (C22 H19 F3 N2 O6 S)

Compound Name

N-(3,4-dimethoxyphenyl)-3-nitro-N-{[4-(trifluoromethyl)phenyl]methyl}benzene-1-sulfonamide

IUPAC name

N-(34-dimethoxyphenyl)-3-nitro-N-{[4-(trifluoromethyl)phenyl]methyl}benzene-1-sulfonamide

SMILES

COc(ccc(N(Cc1ccc(C(F)(F)F)cc1)S(c1cc([N+]([O-])=O)ccc1)(=O)=O)c1)c1OC

InChI

InChI=1S/C22H19F3N2O6S/c1-32-20-11-10-17(13-21(20)33-2)26(14-15-6-8-16(9-7-15)22(23,24)25)34(30,31)19-5-3-4-18(12-19)27(28)29/h3-13H,14H2,1-2H3

InChI Key

LTYMIVGBGPKPTI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19877637

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

496.46

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.851

Distribution Coefficient, logD

4.851

Water Solubility, LogSw

-4.80

Polar Surface Area

80.435

Acid Dissociation Constant (pKa)

25.25

Base Dissociation Constant (pKb)

-12.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

V010-4443 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Antimitotic Tubulin Library (17355 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with V010-4443 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V010-4443?
Check Price and Availability of V010-4443, 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 V010-4443 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V010-4443
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V010-4443
  • 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 V010-4443 available by request