K783-6674 Screening compound: 4-[(4-chlorophenyl)methyl]-N-[(oxolan-2-yl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide

K783-6674 Screening compound: 4-[(4-chlorophenyl)methyl]-N-[(oxolan-2-yl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
K783-6674 Screening compound: 4-[(4-chlorophenyl)methyl]-N-[(oxolan-2-yl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K783-6674
4-[(4-chlorophenyl)methyl]-N-[(oxolan-2-yl)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

K783-6674

Molecular Formula

C21H23ClN2O2S (C21 H23 ClN2 O2 S)

Compound Name

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

IUPAC name

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

SMILES

O=C(c(cc1)cc2c1SCCN2Cc(cc1)ccc1Cl)NCC1OCCC1

InChI

InChI=1S/C21H23ClN2O2S/c22-17-6-3-15(4-7-17)14-24-9-11-27-20-8-5-16(12-19(20)24)21(25)23-13-18-2-1-10-26-18/h3-8,12,18H,1-2,9-11,13-14H2,(H,23,25)/t18-/m1/s1

InChI Key

AXBBZTUFPUXBFM-GOSISDBHSA-N

MDL Number (MFCD)

MFCD15096520

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.94

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.538

Distribution Coefficient, logD

3.538

Water Solubility, LogSw

-4.11

Polar Surface Area

35.869

Acid Dissociation Constant (pKa)

14.53

Base Dissociation Constant (pKb)

-1.49

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.10

K783-6674 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Annotated Library (21441 compounds)

CNS targets activity set (6557 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Agro:
  • Agro

References: we are preparing a list of scientific research reports with K783-6674 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K783-6674?
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What is the minimum amount of K783-6674 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K783-6674
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K783-6674
  • 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 K783-6674 available by request