4964-2084 Screening compound: (3,5-dimethoxyphenyl)[4-(4-pyridylmethyl)piperazino]methanone

4964-2084 Screening compound: (3,5-dimethoxyphenyl)[4-(4-pyridylmethyl)piperazino]methanone
4964-2084 Screening compound: (3,5-dimethoxyphenyl)[4-(4-pyridylmethyl)piperazino]methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound 4964-2084
(3,5-dimethoxyphenyl)[4-(4-pyridylmethyl)piperazino]methanone

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

4964-2084

Molecular Formula

C19H23N3O3 (C19 H23 N3 O3)

Compound Name

(3,5-dimethoxyphenyl)[4-(4-pyridylmethyl)piperazino]methanone

IUPAC name

1-(35-dimethoxybenzoyl)-4-[(pyridin-4-yl)methyl]piperazine

SMILES

COc1cc(C(N2CCN(Cc3ccncc3)CC2)=O)cc(OC)c1

InChI

InChI=1S/C19H23N3O3/c1-24-17-11-16(12-18(13-17)25-2)19(23)22-9-7-21(8-10-22)14-15-3-5-20-6-4-15/h3-6,11-13H,7-10,14H2,1-2H3

InChI Key

ONHIRFWQHRNEKN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02107754

Chemical and Physical Properties

Saltdata

HOOCCOOH

Molecular Weight

341.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.261

Distribution Coefficient, logD

1.237

Water Solubility, LogSw

-1.56

Polar Surface Area

44.943

Acid Dissociation Constant (pKa)

28.54

Base Dissociation Constant (pKb)

6.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.84

4964-2084 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with 4964-2084 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4964-2084?
Check Price and Availability of 4964-2084, 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 4964-2084 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4964-2084
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4964-2084
  • 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 4964-2084 available by request