V018-1646 Screening compound: 5-fluoro-N-[1-(4-methoxyphenyl)ethyl]-2-methyl-N-phenylbenzene-1-sulfonamide

V018-1646 Screening compound: 5-fluoro-N-[1-(4-methoxyphenyl)ethyl]-2-methyl-N-phenylbenzene-1-sulfonamide
V018-1646 Screening compound: 5-fluoro-N-[1-(4-methoxyphenyl)ethyl]-2-methyl-N-phenylbenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-1646
5-fluoro-N-[1-(4-methoxyphenyl)ethyl]-2-methyl-N-phenylbenzene-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

V018-1646

Molecular Formula

C22H22FNO3S (C22 H22 FNO3 S)

Compound Name

5-fluoro-N-[1-(4-methoxyphenyl)ethyl]-2-methyl-N-phenylbenzene-1-sulfonamide

IUPAC name

5-fluoro-N-[1-(4-methoxyphenyl)ethyl]-2-methyl-N-phenylbenzene-1-sulfonamide

SMILES

CC(c(cc1)ccc1OC)N(c1ccccc1)S(c1c(C)ccc(F)c1)(=O)=O

InChI

InChI=1S/C22H22FNO3S/c1-16-9-12-19(23)15-22(16)28(25,26)24(20-7-5-4-6-8-20)17(2)18-10-13-21(27-3)14-11-18/h4-15,17H,1-3H3/t17-/m0/s1

InChI Key

RLPWUCBHHDTWMK-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD19878605

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.447

Distribution Coefficient, logD

5.447

Water Solubility, LogSw

-5.58

Polar Surface Area

39.846

Acid Dissociation Constant (pKa)

22.89

Base Dissociation Constant (pKb)

-12.17

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

18.20

V018-1646 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with V018-1646 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-1646?
Check Price and Availability of V018-1646, 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 V018-1646 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-1646
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-1646
  • 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 V018-1646 available by request