V001-3019 Screening compound: 1-(cyclohexylmethyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]-1H-1,3-benzodiazole

V001-3019 Screening compound: 1-(cyclohexylmethyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]-1H-1,3-benzodiazole
V001-3019 Screening compound: 1-(cyclohexylmethyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound V001-3019
1-(cyclohexylmethyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]-1H-1,3-benzodiazole

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

V001-3019

Molecular Formula

C25H36N4O (C25 H36 N4 O)

Compound Name

1-(cyclohexylmethyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]-1H-1,3-benzodiazole

IUPAC name

1-(cyclohexylmethyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]-1H-13-benzodiazole

SMILES

O=C(C(CC1)CCN1c1nc(cccc2)c2n1CC1CCCCC1)N1CCCCC1

InChI

InChI=1S/C25H36N4O/c30-24(27-15-7-2-8-16-27)21-13-17-28(18-14-21)25-26-22-11-5-6-12-23(22)29(25)19-20-9-3-1-4-10-20/h5-6,11-12,20-21H,1-4,7-10,13-19H2

InChI Key

AEMVWPAQEKEQIU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19968694

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

408.59

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.585

Distribution Coefficient, logD

5.576

Water Solubility, LogSw

-5.72

Polar Surface Area

30.001

Acid Dissociation Constant (pKa)

21.91

Base Dissociation Constant (pKb)

8.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

68.00

V001-3019 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

GPCR Targeted Library (31838 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Nucleic Acid Ligands (8311 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Hemic and lymphatic
  • Cardiovascular
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V001-3019 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V001-3019?
Check Price and Availability of V001-3019, 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 V001-3019 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V001-3019
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V001-3019
  • 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 V001-3019 available by request