8019-8877 Screening compound: benzyl N-[4-(pyridine-4-carbonyl)phenyl]carbamate

8019-8877 Screening compound: benzyl N-[4-(pyridine-4-carbonyl)phenyl]carbamate
8019-8877 Screening compound: benzyl N-[4-(pyridine-4-carbonyl)phenyl]carbamate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-8877
benzyl N-[4-(pyridine-4-carbonyl)phenyl]carbamate

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

8019-8877

Molecular Formula

C20H16N2O3 (C20 H16 N2 O3)

Compound Name

benzyl N-[4-(pyridine-4-carbonyl)phenyl]carbamate

IUPAC name

benzyl N-[4-(pyridine-4-carbonyl)phenyl]carbamate

SMILES

O=C(c(cc1)ccc1NC(OCc1ccccc1)=O)c1ccncc1

InChI

InChI=1S/C20H16N2O3/c23-19(17-10-12-21-13-11-17)16-6-8-18(9-7-16)22-20(24)25-14-15-4-2-1-3-5-15/h1-13H,14H2,(H,22,24)

InChI Key

IHVVRBWDEHYIFG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12034041

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

332.36

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.734

Distribution Coefficient, logD

3.733

Water Solubility, LogSw

-4.11

Polar Surface Area

54.681

Acid Dissociation Constant (pKa)

10.22

Base Dissociation Constant (pKb)

3.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.00

8019-8877 in Drug Discovery

Included in Screening Libraries

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

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 8019-8877 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-8877?
Check Price and Availability of 8019-8877, 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 8019-8877 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-8877
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-8877
  • 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 8019-8877 available by request