K783-6495 Screening compound: N-[(2-chlorophenyl)methyl]-4-[(4-chlorophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide

K783-6495 Screening compound: N-[(2-chlorophenyl)methyl]-4-[(4-chlorophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
K783-6495 Screening compound: N-[(2-chlorophenyl)methyl]-4-[(4-chlorophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K783-6495
N-[(2-chlorophenyl)methyl]-4-[(4-chlorophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-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

K783-6495

Molecular Formula

C23H20Cl2N2OS (C23 H20 Cl2 N2 OS)

Compound Name

N-[(2-chlorophenyl)methyl]-4-[(4-chlorophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide

IUPAC name

N-[(2-chlorophenyl)methyl]-4-[(4-chlorophenyl)methyl]-34-dihydro-2H-14-benzothiazine-6-carboxamide

SMILES

O=C(c(cc1)cc2c1SCCN2Cc(cc1)ccc1Cl)NCc(cccc1)c1Cl

InChI

InChI=1S/C23H20Cl2N2OS/c24-19-8-5-16(6-9-19)15-27-11-12-29-22-10-7-17(13-21(22)27)23(28)26-14-18-3-1-2-4-20(18)25/h1-10,13H,11-12,14-15H2,(H,26,28)

InChI Key

OTNAIEJXDNOBSI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15096439

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.4

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.770

Distribution Coefficient, logD

5.770

Water Solubility, LogSw

-6.04

Polar Surface Area

27.215

Acid Dissociation Constant (pKa)

13.34

Base Dissociation Constant (pKb)

-1.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

K783-6495 in Drug Discovery

Included in Screening Libraries

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

Cyclic Ugi PPI Library (9586 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with K783-6495 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K783-6495?
Check Price and Availability of K783-6495, 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 K783-6495 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K783-6495
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K783-6495
  • 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 K783-6495 available by request