G876-0034 Screening compound: ethyl 4-(2-{5-methoxy-4-oxo-2-[(piperidin-1-yl)methyl]-1,4-dihydropyridin-1-yl}acetamido)benzoate

G876-0034 Screening compound: ethyl 4-(2-{5-methoxy-4-oxo-2-[(piperidin-1-yl)methyl]-1,4-dihydropyridin-1-yl}acetamido)benzoate
G876-0034 Screening compound: ethyl 4-(2-{5-methoxy-4-oxo-2-[(piperidin-1-yl)methyl]-1,4-dihydropyridin-1-yl}acetamido)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound G876-0034
ethyl 4-(2-{5-methoxy-4-oxo-2-[(piperidin-1-yl)methyl]-1,4-dihydropyridin-1-yl}acetamido)benzoate

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

G876-0034

Molecular Formula

C23H29N3O5 (C23 H29 N3 O5)

Compound Name

ethyl 4-(2-{5-methoxy-4-oxo-2-[(piperidin-1-yl)methyl]-1,4-dihydropyridin-1-yl}acetamido)benzoate

IUPAC name

ethyl 4-(2-{5-methoxy-4-oxo-2-[(piperidin-1-yl)methyl]-14-dihydropyridin-1-yl}acetamido)benzoate

SMILES

CCOC(c(cc1)ccc1NC(CN(C=C1OC)C(CN2CCCCC2)=CC1=O)=O)=O

InChI

InChI=1S/C23H29N3O5/c1-3-31-23(29)17-7-9-18(10-8-17)24-22(28)16-26-15-21(30-2)20(27)13-19(26)14-25-11-5-4-6-12-25/h7-10,13,15H,3-6,11-12,14,16H2,1-2H3,(H,24,28)

InChI Key

IBRXVNGFNQBTMQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09239097

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.5

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.447

Distribution Coefficient, logD

2.227

Water Solubility, LogSw

-2.80

Polar Surface Area

70.981

Acid Dissociation Constant (pKa)

10.86

Base Dissociation Constant (pKb)

7.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.50

G876-0034 in Drug Discovery

Included in Screening Libraries

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

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 G876-0034 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G876-0034?
Check Price and Availability of G876-0034, 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 G876-0034 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G876-0034
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G876-0034
  • 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 G876-0034 available by request