0703-6325 Screening compound: methyl 6-[(4-acetylphenyl)carbamoyl]pyridine-2-carboxylate

0703-6325 Screening compound: methyl 6-[(4-acetylphenyl)carbamoyl]pyridine-2-carboxylate
0703-6325 Screening compound: methyl 6-[(4-acetylphenyl)carbamoyl]pyridine-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 0703-6325
methyl 6-[(4-acetylphenyl)carbamoyl]pyridine-2-carboxylate

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

0703-6325

Molecular Formula

C16H14N2O4 (C16 H14 N2 O4)

Compound Name

methyl 6-[(4-acetylphenyl)carbamoyl]pyridine-2-carboxylate

IUPAC name

methyl 6-[(4-acetylphenyl)carbamoyl]pyridine-2-carboxylate

SMILES

CC(c(cc1)ccc1NC(c1cccc(C(OC)=O)n1)=O)=O

InChI

InChI=1S/C16H14N2O4/c1-10(19)11-6-8-12(9-7-11)17-15(20)13-4-3-5-14(18-13)16(21)22-2/h3-9H,1-2H3,(H,17,20)

InChI Key

IPQKGCHLSOOQBR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00805896

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

298.3

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.850

Distribution Coefficient, logD

1.821

Water Solubility, LogSw

-2.22

Polar Surface Area

66.946

Acid Dissociation Constant (pKa)

8.56

Base Dissociation Constant (pKb)

-2.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

0703-6325 in Drug Discovery

Included in Screening Libraries

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

Frequent Hitters Library (7624 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
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 0703-6325 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0703-6325?
Check Price and Availability of 0703-6325, 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 0703-6325 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0703-6325
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0703-6325
  • 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 0703-6325 available by request