0777-4657 Screening compound: 4-(5-ethylpyridin-2-yl)-N-(3-nitrophenyl)benzamide

0777-4657 Screening compound: 4-(5-ethylpyridin-2-yl)-N-(3-nitrophenyl)benzamide
0777-4657 Screening compound: 4-(5-ethylpyridin-2-yl)-N-(3-nitrophenyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0777-4657
4-(5-ethylpyridin-2-yl)-N-(3-nitrophenyl)benzamide

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

0777-4657

Molecular Formula

C20H17N3O3 (C20 H17 N3 O3)

Compound Name

4-(5-ethylpyridin-2-yl)-N-(3-nitrophenyl)benzamide

IUPAC name

4-(5-ethylpyridin-2-yl)-N-(3-nitrophenyl)benzamide

SMILES

CCc(cc1)cnc1-c(cc1)ccc1C(Nc1cccc([N+]([O-])=O)c1)=O

InChI

InChI=1S/C20H17N3O3/c1-2-14-6-11-19(21-13-14)15-7-9-16(10-8-15)20(24)22-17-4-3-5-18(12-17)23(25)26/h3-13H,2H2,1H3,(H,22,24)

InChI Key

DTZORDSSQDXTHO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00991735

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

347.37

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.758

Distribution Coefficient, logD

4.720

Water Solubility, LogSw

-4.41

Polar Surface Area

65.577

Acid Dissociation Constant (pKa)

8.67

Base Dissociation Constant (pKb)

5.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

0777-4657 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with 0777-4657 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0777-4657?
Check Price and Availability of 0777-4657, 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 0777-4657 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0777-4657
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0777-4657
  • 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 0777-4657 available by request