2742-2799 Screening compound: (2Z)-N-(2-fluorophenyl)-2-[(3-methoxyphenyl)imino]-3-methyl-4-oxo-1,3-thiazinane-6-carboxamide

2742-2799 Screening compound: (2Z)-N-(2-fluorophenyl)-2-[(3-methoxyphenyl)imino]-3-methyl-4-oxo-1,3-thiazinane-6-carboxamide
2742-2799 Screening compound: (2Z)-N-(2-fluorophenyl)-2-[(3-methoxyphenyl)imino]-3-methyl-4-oxo-1,3-thiazinane-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2742-2799
(2Z)-N-(2-fluorophenyl)-2-[(3-methoxyphenyl)imino]-3-methyl-4-oxo-1,3-thiazinane-6-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

2742-2799

Molecular Formula

C19H18FN3O3S (C19 H18 FN3 O3 S)

Compound Name

(2Z)-N-(2-fluorophenyl)-2-[(3-methoxyphenyl)imino]-3-methyl-4-oxo-1,3-thiazinane-6-carboxamide

IUPAC name

(2Z)-N-(2-fluorophenyl)-2-[(3-methoxyphenyl)imino]-3-methyl-4-oxo-13-thiazinane-6-carboxamide

SMILES

CN(C(CC(C(Nc(cccc1)c1F)=O)S1)=O)/C1=N/c1cc(OC)ccc1

InChI

InChI=1S/C19H18FN3O3S/c1-23-17(24)11-16(18(25)22-15-9-4-3-8-14(15)20)27-19(23)21-12-6-5-7-13(10-12)26-2/h3-10,16H,11H2,1-2H3,(H,22,25)/t16-/m0/s1

InChI Key

WGWDBMPSDCGWMQ-INIZCTEOSA-N

MDL Number (MFCD)

MFCD02146925

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.301

Distribution Coefficient, logD

3.300

Water Solubility, LogSw

-3.73

Polar Surface Area

55.022

Acid Dissociation Constant (pKa)

10.62

Base Dissociation Constant (pKb)

4.28

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

21.10

2742-2799 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with 2742-2799 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2742-2799?
Check Price and Availability of 2742-2799, 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 2742-2799 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2742-2799
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2742-2799
  • 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 2742-2799 available by request