F390-0036 Screening compound: 2-benzoyl-4-(4-chlorophenyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione

F390-0036 Screening compound: 2-benzoyl-4-(4-chlorophenyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione
F390-0036 Screening compound: 2-benzoyl-4-(4-chlorophenyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound F390-0036
2-benzoyl-4-(4-chlorophenyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione

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

F390-0036

Molecular Formula

C21H14ClNO3S (C21 H14 ClNO3 S)

Compound Name

2-benzoyl-4-(4-chlorophenyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione

IUPAC name

2-benzoyl-4-(4-chlorophenyl)-4H-1lambda64-benzothiazine-11-dione

SMILES

O=C(c1ccccc1)C1=CN(c(cc2)ccc2Cl)c(cccc2)c2S1(=O)=O

InChI

InChI=1S/C21H14ClNO3S/c22-16-10-12-17(13-11-16)23-14-20(21(24)15-6-2-1-3-7-15)27(25,26)19-9-5-4-8-18(19)23/h1-14H

InChI Key

CQTIFGBTBYOHGO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14953264

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.87

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.962

Distribution Coefficient, logD

3.962

Water Solubility, LogSw

-4.55

Polar Surface Area

44.417

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

-2.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

F390-0036 in Drug Discovery

Included in Screening Libraries

Nucleic Acid Ligands (8311 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system

References: we are preparing a list of scientific research reports with F390-0036 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F390-0036?
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What is the minimum amount of F390-0036 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F390-0036
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F390-0036
  • 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 F390-0036 available by request