K788-2474 Screening compound: 2-[(2Z)-2-[(4-ethylphenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl]-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}acetamide

K788-2474 Screening compound: 2-[(2Z)-2-[(4-ethylphenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl]-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}acetamide
K788-2474 Screening compound: 2-[(2Z)-2-[(4-ethylphenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl]-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K788-2474
2-[(2Z)-2-[(4-ethylphenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl]-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}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

K788-2474

Molecular Formula

C33H38N4O3S (C33 H38 N4 O3 S)

Compound Name

2-[(2Z)-2-[(4-ethylphenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl]-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}acetamide

IUPAC name

2-[(2Z)-2-[(4-ethylphenyl)methylidene]-3-oxo-34-dihydro-2H-14-benzothiazin-4-yl]-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}acetamide

SMILES

CCc1ccc(/C=C2\Sc(cccc3)c3N(CC(NCCCN(CC3)CCN3c(cc3)ccc3OC)=O)C2=O)cc1

InChI

InChI=1S/C33H38N4O3S/c1-3-25-9-11-26(12-10-25)23-31-33(39)37(29-7-4-5-8-30(29)41-31)24-32(38)34-17-6-18-35-19-21-36(22-20-35)27-13-15-28(40-2)16-14-27/h4-5,7-16,23H,3,6,17-22,24H2,1-2H3,(H,34,38)

InChI Key

DLUXBIWFXCOOCL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15103866

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

570.76

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.430

Distribution Coefficient, logD

4.844

Water Solubility, LogSw

-5.24

Polar Surface Area

54.169

Acid Dissociation Constant (pKa)

15.78

Base Dissociation Constant (pKb)

7.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with K788-2474 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K788-2474?
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What is the minimum amount of K788-2474 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K788-2474
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K788-2474
  • 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 K788-2474 available by request