V014-2541 Screening compound: 1-(2-phenylethyl)-2-[4-(pyrrolidine-1-carbonyl)piperidin-1-yl]-1H-1,3-benzodiazole

V014-2541 Screening compound: 1-(2-phenylethyl)-2-[4-(pyrrolidine-1-carbonyl)piperidin-1-yl]-1H-1,3-benzodiazole
V014-2541 Screening compound: 1-(2-phenylethyl)-2-[4-(pyrrolidine-1-carbonyl)piperidin-1-yl]-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-2541
1-(2-phenylethyl)-2-[4-(pyrrolidine-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

V014-2541

Molecular Formula

C25H30N4O (C25 H30 N4 O)

Compound Name

1-(2-phenylethyl)-2-[4-(pyrrolidine-1-carbonyl)piperidin-1-yl]-1H-1,3-benzodiazole

IUPAC name

1-(2-phenylethyl)-2-[4-(pyrrolidine-1-carbonyl)piperidin-1-yl]-1H-13-benzodiazole

SMILES

O=C(C(CC1)CCN1c1nc(cccc2)c2n1CCc1ccccc1)N1CCCC1

InChI

InChI=1S/C25H30N4O/c30-24(27-15-6-7-16-27)21-13-17-28(18-14-21)25-26-22-10-4-5-11-23(22)29(25)19-12-20-8-2-1-3-9-20/h1-5,8-11,21H,6-7,12-19H2

InChI Key

MOYVFPYCIJVBAR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19970826

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

402.54

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.725

Distribution Coefficient, logD

4.723

Water Solubility, LogSw

-4.73

Polar Surface Area

30.153

Acid Dissociation Constant (pKa)

21.91

Base Dissociation Constant (pKb)

5.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.00

V014-2541 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 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:
  • Infections
  • Immune system
  • animal
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Hemic and lymphatic
  • Cardiovascular
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system
Agro:
  • Agro
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V014-2541 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-2541?
Check Price and Availability of V014-2541, 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 V014-2541 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-2541
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-2541
  • 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 V014-2541 available by request