E862-0046 Screening compound: N-(3-fluoro-4-methylphenyl)-1H,2H,3H-pyrido[2,3-b][1,4]thiazine-1-carboxamide

E862-0046 Screening compound: N-(3-fluoro-4-methylphenyl)-1H,2H,3H-pyrido[2,3-b][1,4]thiazine-1-carboxamide
E862-0046 Screening compound: N-(3-fluoro-4-methylphenyl)-1H,2H,3H-pyrido[2,3-b][1,4]thiazine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E862-0046
N-(3-fluoro-4-methylphenyl)-1H,2H,3H-pyrido[2,3-b][1,4]thiazine-1-carboxamide

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

E862-0046

Molecular Formula

C15H14FN3OS (C15 H14 FN3 OS)

Compound Name

N-(3-fluoro-4-methylphenyl)-1H,2H,3H-pyrido[2,3-b][1,4]thiazine-1-carboxamide

IUPAC name

N-(3-fluoro-4-methylphenyl)-1H2H3H-pyrido[23-b][14]thiazine-1-carboxamide

SMILES

Cc(ccc(NC(N1c2cccnc2SCC1)=O)c1)c1F

InChI

InChI=1S/C15H14FN3OS/c1-10-4-5-11(9-12(10)16)18-15(20)19-7-8-21-14-13(19)3-2-6-17-14/h2-6,9H,7-8H2,1H3,(H,18,20)

InChI Key

QBKIWUJMSUQVQL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14924129

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

303.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.198

Distribution Coefficient, logD

3.198

Water Solubility, LogSw

-3.36

Polar Surface Area

35.425

Acid Dissociation Constant (pKa)

12.02

Base Dissociation Constant (pKb)

1.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

E862-0046 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with E862-0046 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E862-0046?
Check Price and Availability of E862-0046, 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 E862-0046 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E862-0046
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E862-0046
  • 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 E862-0046 available by request