K788-1072 Screening compound: (2Z)-4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-2-(phenylmethylidene)-3,4-dihydro-2H-1,4-benzothiazin-3-one

K788-1072 Screening compound: (2Z)-4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-2-(phenylmethylidene)-3,4-dihydro-2H-1,4-benzothiazin-3-one
K788-1072 Screening compound: (2Z)-4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-2-(phenylmethylidene)-3,4-dihydro-2H-1,4-benzothiazin-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound K788-1072
(2Z)-4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-2-(phenylmethylidene)-3,4-dihydro-2H-1,4-benzothiazin-3-one

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

K788-1072

Molecular Formula

C22H23N3O2S (C22 H23 N3 O2 S)

Compound Name

(2Z)-4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-2-(phenylmethylidene)-3,4-dihydro-2H-1,4-benzothiazin-3-one

IUPAC name

(2Z)-4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-2-(phenylmethylidene)-34-dihydro-2H-14-benzothiazin-3-one

SMILES

CN(CC1)CCN1C(CN(c(cccc1)c1S/C1=C\c2ccccc2)C1=O)=O

InChI

InChI=1S/C22H23N3O2S/c1-23-11-13-24(14-12-23)21(26)16-25-18-9-5-6-10-19(18)28-20(22(25)27)15-17-7-3-2-4-8-17/h2-10,15H,11-14,16H2,1H3

InChI Key

FEGGKTBKZCCIBT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15102851

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.51

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.801

Distribution Coefficient, logD

2.671

Water Solubility, LogSw

-3.18

Polar Surface Area

34.939

Acid Dissociation Constant (pKa)

22.41

Base Dissociation Constant (pKb)

6.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

References: we are preparing a list of scientific research reports with K788-1072 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K788-1072?
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What is the minimum amount of K788-1072 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K788-1072
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K788-1072
  • 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 K788-1072 available by request