F810-0124 Screening compound: methyl 4-(2-{9-methyl-3-oxo-2H,3H-[1,2,4]triazolo[4,3-c]quinazolin-2-yl}acetamido)benzoate

F810-0124 Screening compound: methyl 4-(2-{9-methyl-3-oxo-2H,3H-[1,2,4]triazolo[4,3-c]quinazolin-2-yl}acetamido)benzoate
F810-0124 Screening compound: methyl 4-(2-{9-methyl-3-oxo-2H,3H-[1,2,4]triazolo[4,3-c]quinazolin-2-yl}acetamido)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound F810-0124
methyl 4-(2-{9-methyl-3-oxo-2H,3H-[1,2,4]triazolo[4,3-c]quinazolin-2-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

F810-0124

Molecular Formula

C20H17N5O4 (C20 H17 N5 O4)

Compound Name

methyl 4-(2-{9-methyl-3-oxo-2H,3H-[1,2,4]triazolo[4,3-c]quinazolin-2-yl}acetamido)benzoate

IUPAC name

methyl 4-(2-{9-methyl-3-oxo-2H3H-[124]triazolo[43-c]quinazolin-2-yl}acetamido)benzoate

SMILES

Cc(cc1)cc(C2=NN3CC(Nc(cc4)ccc4C(OC)=O)=O)c1N=CN2C3=O

InChI

InChI=1S/C20H17N5O4/c1-12-3-8-16-15(9-12)18-23-25(20(28)24(18)11-21-16)10-17(26)22-14-6-4-13(5-7-14)19(27)29-2/h3-9,11H,10H2,1-2H3,(H,22,26)

InChI Key

XMLHCHGGTVREGS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27192981

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

391.39

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.581

Distribution Coefficient, logD

2.581

Water Solubility, LogSw

-3.19

Polar Surface Area

86.011

Acid Dissociation Constant (pKa)

11.64

Base Dissociation Constant (pKb)

4.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

F810-0124 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with F810-0124 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F810-0124?
Check Price and Availability of F810-0124, 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 F810-0124 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F810-0124
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F810-0124
  • 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 F810-0124 available by request