P798-0094 Screening compound: 4-(3-FLUOROPHENYL)-3-METHYL-1LAMBDA6-PYRIDO[2

P798-0094 Screening compound: 4-(3-FLUOROPHENYL)-3-METHYL-1LAMBDA6-PYRIDO[2
P798-0094 Screening compound: 4-(3-FLUOROPHENYL)-3-METHYL-1LAMBDA6-PYRIDO[2 alternative view

Chemical Structure Depiction of ChemDiv screening compound P798-0094
4-(3-FLUOROPHENYL)-3-METHYL-1LAMBDA6-PYRIDO[2

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

P798-0094

Molecular Formula

C13H10FN3O2S (C13 H10 FN3 O2 S)

Compound Name

4-(3-FLUOROPHENYL)-3-METHYL-1LAMBDA6-PYRIDO[2

IUPAC name

n/a

SMILES

CC(N(c1cc(F)ccc1)c1c2cccn1)=NS2(=O)=O

InChI

InChI=1S/C13H10FN3O2S/c1-9-16-20(18,19)12-6-3-7-15-13(12)17(9)11-5-2-4-10(14)8-11/h2-8H,1H3

InChI Key

ASDSTORDKFCOJO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27614994

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

291.31

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.518

Distribution Coefficient, logD

1.516

Water Solubility, LogSw

-2.08

Polar Surface Area

52.047

Acid Dissociation Constant (pKa)

20.06

Base Dissociation Constant (pKb)

4.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

2.00

P798-0094 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments

References: we are preparing a list of scientific research reports with P798-0094 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P798-0094?
Check Price and Availability of P798-0094, 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 P798-0094 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P798-0094
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P798-0094
  • 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 P798-0094 available by request