V018-8204 Screening compound: N-[(4-methoxyphenyl)methyl]-2-[4-(3-methyl-1-benzofuran-2-carbonyl)piperazin-1-yl]pyridine-3-carboxamide

V018-8204 Screening compound: N-[(4-methoxyphenyl)methyl]-2-[4-(3-methyl-1-benzofuran-2-carbonyl)piperazin-1-yl]pyridine-3-carboxamide
V018-8204 Screening compound: N-[(4-methoxyphenyl)methyl]-2-[4-(3-methyl-1-benzofuran-2-carbonyl)piperazin-1-yl]pyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-8204
N-[(4-methoxyphenyl)methyl]-2-[4-(3-methyl-1-benzofuran-2-carbonyl)piperazin-1-yl]pyridine-3-carboxamide

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

V018-8204

Molecular Formula

C28H28N4O4 (C28 H28 N4 O4)

Compound Name

N-[(4-methoxyphenyl)methyl]-2-[4-(3-methyl-1-benzofuran-2-carbonyl)piperazin-1-yl]pyridine-3-carboxamide

IUPAC name

N-[(4-methoxyphenyl)methyl]-2-[4-(3-methyl-1-benzofuran-2-carbonyl)piperazin-1-yl]pyridine-3-carboxamide

SMILES

Cc1c(C(N(CC2)CCN2c(nccc2)c2C(NCc(cc2)ccc2OC)=O)=O)oc2c1cccc2

InChI

InChI=1S/C28H28N4O4/c1-19-22-6-3-4-8-24(22)36-25(19)28(34)32-16-14-31(15-17-32)26-23(7-5-13-29-26)27(33)30-18-20-9-11-21(35-2)12-10-20/h3-13H,14-18H2,1-2H3,(H,30,33)

InChI Key

VXQWXGDARHVFLP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19946229

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

484.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.542

Distribution Coefficient, logD

4.541

Water Solubility, LogSw

-4.25

Polar Surface Area

69.611

Acid Dissociation Constant (pKa)

12.08

Base Dissociation Constant (pKb)

4.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

V018-8204 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS Targets (44014 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with V018-8204 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-8204?
Check Price and Availability of V018-8204, 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 V018-8204 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-8204
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-8204
  • 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 V018-8204 available by request