G876-0245 Screening compound: 2-{5-methoxy-2-[(morpholin-4-yl)methyl]-4-oxo-1,4-dihydropyridin-1-yl}-N-(4-nitrophenyl)acetamide

G876-0245 Screening compound: 2-{5-methoxy-2-[(morpholin-4-yl)methyl]-4-oxo-1,4-dihydropyridin-1-yl}-N-(4-nitrophenyl)acetamide
G876-0245 Screening compound: 2-{5-methoxy-2-[(morpholin-4-yl)methyl]-4-oxo-1,4-dihydropyridin-1-yl}-N-(4-nitrophenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G876-0245
2-{5-methoxy-2-[(morpholin-4-yl)methyl]-4-oxo-1,4-dihydropyridin-1-yl}-N-(4-nitrophenyl)acetamide

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

G876-0245

Molecular Formula

C19H22N4O6 (C19 H22 N4 O6)

Compound Name

2-{5-methoxy-2-[(morpholin-4-yl)methyl]-4-oxo-1,4-dihydropyridin-1-yl}-N-(4-nitrophenyl)acetamide

IUPAC name

2-{5-methoxy-2-[(morpholin-4-yl)methyl]-4-oxo-14-dihydropyridin-1-yl}-N-(4-nitrophenyl)acetamide

SMILES

COC1=CN(CC(Nc(cc2)ccc2[N+]([O-])=O)=O)C(CN2CCOCC2)=CC1=O

InChI

InChI=1S/C19H22N4O6/c1-28-18-12-22(16(10-17(18)24)11-21-6-8-29-9-7-21)13-19(25)20-14-2-4-15(5-3-14)23(26)27/h2-5,10,12H,6-9,11,13H2,1H3,(H,20,25)

InChI Key

CKRPPABLMZQUHW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08534423

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.41

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.664

Distribution Coefficient, logD

0.660

Water Solubility, LogSw

-2.26

Polar Surface Area

91.517

Acid Dissociation Constant (pKa)

9.62

Base Dissociation Constant (pKb)

4.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.80

G876-0245 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with G876-0245 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G876-0245?
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What is the minimum amount of G876-0245 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G876-0245
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G876-0245
  • 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 G876-0245 available by request