K788-1056 Screening compound: N-(3-methylbutyl)-2-[(2Z)-2-[(4-methylphenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl]acetamide

K788-1056 Screening compound: N-(3-methylbutyl)-2-[(2Z)-2-[(4-methylphenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl]acetamide
K788-1056 Screening compound: N-(3-methylbutyl)-2-[(2Z)-2-[(4-methylphenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K788-1056
N-(3-methylbutyl)-2-[(2Z)-2-[(4-methylphenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl]acetamide

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

K788-1056

Molecular Formula

C23H26N2O2S (C23 H26 N2 O2 S)

Compound Name

N-(3-methylbutyl)-2-[(2Z)-2-[(4-methylphenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl]acetamide

IUPAC name

N-(3-methylbutyl)-2-[(2Z)-2-[(4-methylphenyl)methylidene]-3-oxo-34-dihydro-2H-14-benzothiazin-4-yl]acetamide

SMILES

CC(C)CCNC(CN(c(cccc1)c1S/C1=C\c2ccc(C)cc2)C1=O)=O

InChI

InChI=1S/C23H26N2O2S/c1-16(2)12-13-24-22(26)15-25-19-6-4-5-7-20(19)28-21(23(25)27)14-18-10-8-17(3)9-11-18/h4-11,14,16H,12-13,15H2,1-3H3,(H,24,26)

InChI Key

XJOSERIHLOZUJQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15102837

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.54

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.919

Distribution Coefficient, logD

4.919

Water Solubility, LogSw

-4.41

Polar Surface Area

39.654

Acid Dissociation Constant (pKa)

14.45

Base Dissociation Constant (pKb)

0.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

References: we are preparing a list of scientific research reports with K788-1056 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K788-1056?
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What is the minimum amount of K788-1056 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K788-1056
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K788-1056
  • 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 K788-1056 available by request