V006-7601 Screening compound: 1-{2-[bis(4-chlorophenyl)methoxy]ethyl}-4-(4-butoxybenzenesulfonyl)piperazine

V006-7601 Screening compound: 1-{2-[bis(4-chlorophenyl)methoxy]ethyl}-4-(4-butoxybenzenesulfonyl)piperazine
V006-7601 Screening compound: 1-{2-[bis(4-chlorophenyl)methoxy]ethyl}-4-(4-butoxybenzenesulfonyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound V006-7601
1-{2-[bis(4-chlorophenyl)methoxy]ethyl}-4-(4-butoxybenzenesulfonyl)piperazine

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

V006-7601

Molecular Formula

C29H34Cl2N2O4S (C29 H34 Cl2 N2 O4 S)

Compound Name

1-{2-[bis(4-chlorophenyl)methoxy]ethyl}-4-(4-butoxybenzenesulfonyl)piperazine

IUPAC name

1-{2-[bis(4-chlorophenyl)methoxy]ethyl}-4-(4-butoxybenzenesulfonyl)piperazine

SMILES

CCCCOc(cc1)ccc1S(N1CCN(CCOC(c(cc2)ccc2Cl)c(cc2)ccc2Cl)CC1)(=O)=O

InChI

InChI=1S/C29H34Cl2N2O4S/c1-2-3-21-36-27-12-14-28(15-13-27)38(34,35)33-18-16-32(17-19-33)20-22-37-29(23-4-8-25(30)9-5-23)24-6-10-26(31)11-7-24/h4-15,29H,2-3,16-22H2,1H3

InChI Key

MHZSIGAGBVRVGP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19965245

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

577.57

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

7.054

Distribution Coefficient, logD

7.047

Water Solubility, LogSw

-6.75

Polar Surface Area

49.788

Acid Dissociation Constant (pKa)

22.76

Base Dissociation Constant (pKb)

5.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.90

V006-7601 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

MCL1 Targeted Library (12200 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Kinases
  • Phosphatases

References: we are preparing a list of scientific research reports with V006-7601 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V006-7601?
Check Price and Availability of V006-7601, 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 V006-7601 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V006-7601
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V006-7601
  • 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 V006-7601 available by request