V008-0685 Screening compound: N-{2-[4-(6-{[1,1'-biphenyl]-4-yl}pyridazin-3-yl)piperazin-1-yl]-2-oxoethyl}-N-butyl-4-methylbenzene-1-sulfonamide

V008-0685 Screening compound: N-{2-[4-(6-{[1,1'-biphenyl]-4-yl}pyridazin-3-yl)piperazin-1-yl]-2-oxoethyl}-N-butyl-4-methylbenzene-1-sulfonamide
V008-0685 Screening compound: N-{2-[4-(6-{[1,1'-biphenyl]-4-yl}pyridazin-3-yl)piperazin-1-yl]-2-oxoethyl}-N-butyl-4-methylbenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-0685
N-{2-[4-(6-{[1,1'-biphenyl]-4-yl}pyridazin-3-yl)piperazin-1-yl]-2-oxoethyl}-N-butyl-4-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

V008-0685

Molecular Formula

C33H37N5O3S (C33 H37 N5 O3 S)

Compound Name

N-{2-[4-(6-{[1,1'-biphenyl]-4-yl}pyridazin-3-yl)piperazin-1-yl]-2-oxoethyl}-N-butyl-4-methylbenzene-1-sulfonamide

IUPAC name

N-{2-[4-(6-{[11'-biphenyl]-4-yl}pyridazin-3-yl)piperazin-1-yl]-2-oxoethyl}-N-butyl-4-methylbenzene-1-sulfonamide

SMILES

CCCCN(CC(N(CC1)CCN1c(cc1)nnc1-c(cc1)ccc1-c1ccccc1)=O)S(c1ccc(C)cc1)(=O)=O

InChI

InChI=1S/C33H37N5O3S/c1-3-4-20-38(42(40,41)30-16-10-26(2)11-17-30)25-33(39)37-23-21-36(22-24-37)32-19-18-31(34-35-32)29-14-12-28(13-15-29)27-8-6-5-7-9-27/h5-19H,3-4,20-25H2,1-2H3

InChI Key

RKXNZHGFAYFXQF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19840761

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

583.75

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

6.337

Distribution Coefficient, logD

6.337

Water Solubility, LogSw

-5.60

Polar Surface Area

71.908

Acid Dissociation Constant (pKa)

23.02

Base Dissociation Constant (pKb)

5.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.30

V008-0685 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with V008-0685 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-0685?
Check Price and Availability of V008-0685, 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 V008-0685 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-0685
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-0685
  • 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 V008-0685 available by request