V029-0087 Screening compound: 1-(1-benzylpiperidin-4-yl)-3-(2,3-dichlorophenyl)-1-[(6-methylpyridin-2-yl)methyl]urea

V029-0087 Screening compound: 1-(1-benzylpiperidin-4-yl)-3-(2,3-dichlorophenyl)-1-[(6-methylpyridin-2-yl)methyl]urea
V029-0087 Screening compound: 1-(1-benzylpiperidin-4-yl)-3-(2,3-dichlorophenyl)-1-[(6-methylpyridin-2-yl)methyl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-0087
1-(1-benzylpiperidin-4-yl)-3-(2,3-dichlorophenyl)-1-[(6-methylpyridin-2-yl)methyl]urea

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

V029-0087

Molecular Formula

C26H28Cl2N4O (C26 H28 Cl2 N4 O)

Compound Name

1-(1-benzylpiperidin-4-yl)-3-(2,3-dichlorophenyl)-1-[(6-methylpyridin-2-yl)methyl]urea

IUPAC name

1-(1-benzylpiperidin-4-yl)-3-(23-dichlorophenyl)-1-[(6-methylpyridin-2-yl)methyl]urea

SMILES

Cc1cccc(CN(C2CCN(Cc3ccccc3)CC2)C(Nc2cccc(Cl)c2Cl)=O)n1

InChI

InChI=1S/C26H28Cl2N4O/c1-19-7-5-10-21(29-19)18-32(26(33)30-24-12-6-11-23(27)25(24)28)22-13-15-31(16-14-22)17-20-8-3-2-4-9-20/h2-12,22H,13-18H2,1H3,(H,30,33)

InChI Key

YQTLANNMICRWED-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01388672

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

483.44

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.075

Distribution Coefficient, logD

5.227

Water Solubility, LogSw

-6.11

Polar Surface Area

36.003

Acid Dissociation Constant (pKa)

10.79

Base Dissociation Constant (pKb)

8.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

V029-0087 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Antiviral
  • Infections
  • Immune system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with V029-0087 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-0087?
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What is the minimum amount of V029-0087 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-0087
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-0087
  • 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 V029-0087 available by request