V004-2176 Screening compound: N-{2-[4-(6-{[1,1'-biphenyl]-4-yl}pyridazin-3-yl)piperazin-1-yl]-2-oxoethyl}-3-methoxy-N-(3-methylbutyl)benzamide

V004-2176 Screening compound: N-{2-[4-(6-{[1,1'-biphenyl]-4-yl}pyridazin-3-yl)piperazin-1-yl]-2-oxoethyl}-3-methoxy-N-(3-methylbutyl)benzamide
V004-2176 Screening compound: N-{2-[4-(6-{[1,1'-biphenyl]-4-yl}pyridazin-3-yl)piperazin-1-yl]-2-oxoethyl}-3-methoxy-N-(3-methylbutyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-2176
N-{2-[4-(6-{[1,1'-biphenyl]-4-yl}pyridazin-3-yl)piperazin-1-yl]-2-oxoethyl}-3-methoxy-N-(3-methylbutyl)benzamide

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

V004-2176

Molecular Formula

C35H39N5O3 (C35 H39 N5 O3)

Compound Name

N-{2-[4-(6-{[1,1'-biphenyl]-4-yl}pyridazin-3-yl)piperazin-1-yl]-2-oxoethyl}-3-methoxy-N-(3-methylbutyl)benzamide

IUPAC name

N-{2-[4-(6-{[11'-biphenyl]-4-yl}pyridazin-3-yl)piperazin-1-yl]-2-oxoethyl}-3-methoxy-N-(3-methylbutyl)benzamide

SMILES

CC(C)CCN(CC(N(CC1)CCN1c(cc1)nnc1-c(cc1)ccc1-c1ccccc1)=O)C(c1cc(OC)ccc1)=O

InChI

InChI=1S/C35H39N5O3/c1-26(2)18-19-40(35(42)30-10-7-11-31(24-30)43-3)25-34(41)39-22-20-38(21-23-39)33-17-16-32(36-37-33)29-14-12-28(13-15-29)27-8-5-4-6-9-27/h4-17,24,26H,18-23,25H2,1-3H3

InChI Key

NQZLVYXNUAZXIA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19840232

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

577.73

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

6.008

Distribution Coefficient, logD

6.008

Water Solubility, LogSw

-5.67

Polar Surface Area

64.288

Acid Dissociation Constant (pKa)

23.01

Base Dissociation Constant (pKb)

5.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.40

References: we are preparing a list of scientific research reports with V004-2176 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-2176?
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What is the minimum amount of V004-2176 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-2176
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-2176
  • 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 V004-2176 available by request