V006-0988 Screening compound: 3-[4-(4-chlorobenzenesulfonyl)piperazin-1-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methoxy-N-methylbenzene-1-sulfonamide

V006-0988 Screening compound: 3-[4-(4-chlorobenzenesulfonyl)piperazin-1-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methoxy-N-methylbenzene-1-sulfonamide
V006-0988 Screening compound: 3-[4-(4-chlorobenzenesulfonyl)piperazin-1-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methoxy-N-methylbenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V006-0988
3-[4-(4-chlorobenzenesulfonyl)piperazin-1-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methoxy-N-methylbenzene-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

V006-0988

Molecular Formula

C28H34ClN3O7S2 (C28 H34 ClN3 O7 S2)

Compound Name

3-[4-(4-chlorobenzenesulfonyl)piperazin-1-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methoxy-N-methylbenzene-1-sulfonamide

IUPAC name

3-[4-(4-chlorobenzenesulfonyl)piperazin-1-yl]-N-[2-(34-dimethoxyphenyl)ethyl]-4-methoxy-N-methylbenzene-1-sulfonamide

SMILES

CN(CCc(cc1)cc(OC)c1OC)S(c(cc1)cc(N(CC2)CCN2S(c(cc2)ccc2Cl)(=O)=O)c1OC)(=O)=O

InChI

InChI=1S/C28H34ClN3O7S2/c1-30(14-13-21-5-11-27(38-3)28(19-21)39-4)40(33,34)24-10-12-26(37-2)25(20-24)31-15-17-32(18-16-31)41(35,36)23-8-6-22(29)7-9-23/h5-12,19-20H,13-18H2,1-4H3

InChI Key

POUZDZUFIBQROA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19950833

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

624.18

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

4.691

Distribution Coefficient, logD

4.691

Water Solubility, LogSw

-4.83

Polar Surface Area

90.343

Acid Dissociation Constant (pKa)

26.15

Base Dissociation Constant (pKb)

1.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.70

V006-0988 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with V006-0988 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V006-0988?
Check Price and Availability of V006-0988, 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 V006-0988 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V006-0988
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V006-0988
  • 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 V006-0988 available by request