G429-0108 Screening compound: (8-methyl-2-oxo-3-{[2-(trifluoromethyl)phenyl]carbamoyl}-2H-pyrano[2,3-c]pyridin-5-yl)methyl propanoate

G429-0108 Screening compound: (8-methyl-2-oxo-3-{[2-(trifluoromethyl)phenyl]carbamoyl}-2H-pyrano[2,3-c]pyridin-5-yl)methyl propanoate
G429-0108 Screening compound: (8-methyl-2-oxo-3-{[2-(trifluoromethyl)phenyl]carbamoyl}-2H-pyrano[2,3-c]pyridin-5-yl)methyl propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound G429-0108
(8-methyl-2-oxo-3-{[2-(trifluoromethyl)phenyl]carbamoyl}-2H-pyrano[2,3-c]pyridin-5-yl)methyl propanoate

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

G429-0108

Molecular Formula

C21H17F3N2O5 (C21 H17 F3 N2 O5)

Compound Name

(8-methyl-2-oxo-3-{[2-(trifluoromethyl)phenyl]carbamoyl}-2H-pyrano[2,3-c]pyridin-5-yl)methyl propanoate

IUPAC name

(8-methyl-2-oxo-3-{[2-(trifluoromethyl)phenyl]carbamoyl}-2H-pyrano[23-c]pyridin-5-yl)methyl propanoate

SMILES

CCC(OCc1cnc(C)c(O2)c1C=C(C(Nc1c(C(F)(F)F)cccc1)=O)C2=O)=O

InChI

InChI=1S/C21H17F3N2O5/c1-3-17(27)30-10-12-9-25-11(2)18-13(12)8-14(20(29)31-18)19(28)26-16-7-5-4-6-15(16)21(22,23)24/h4-9H,3,10H2,1-2H3,(H,26,28)

InChI Key

AXUBCSBDEIHGHV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15013593

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.37

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.519

Distribution Coefficient, logD

3.519

Water Solubility, LogSw

-3.77

Polar Surface Area

73.486

Acid Dissociation Constant (pKa)

10.38

Base Dissociation Constant (pKb)

-0.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

G429-0108 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G429-0108 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G429-0108?
Check Price and Availability of G429-0108, 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 G429-0108 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G429-0108
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G429-0108
  • 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 G429-0108 available by request