K788-9474 Screening compound: (2Z)-N-[2-(2-methylpiperidin-1-yl)ethyl]-3-oxo-2-(phenylmethylidene)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide

K788-9474 Screening compound: (2Z)-N-[2-(2-methylpiperidin-1-yl)ethyl]-3-oxo-2-(phenylmethylidene)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
K788-9474 Screening compound: (2Z)-N-[2-(2-methylpiperidin-1-yl)ethyl]-3-oxo-2-(phenylmethylidene)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K788-9474
(2Z)-N-[2-(2-methylpiperidin-1-yl)ethyl]-3-oxo-2-(phenylmethylidene)-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

K788-9474

Molecular Formula

C24H27N3O2S (C24 H27 N3 O2 S)

Compound Name

(2Z)-N-[2-(2-methylpiperidin-1-yl)ethyl]-3-oxo-2-(phenylmethylidene)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide

IUPAC name

(2Z)-N-[2-(2-methylpiperidin-1-yl)ethyl]-3-oxo-2-(phenylmethylidene)-34-dihydro-2H-14-benzothiazine-6-carboxamide

SMILES

CC1N(CCNC(c(cc2)cc(NC3=O)c2S/C3=C\c2ccccc2)=O)CCCC1

InChI

InChI=1S/C24H27N3O2S/c1-17-7-5-6-13-27(17)14-12-25-23(28)19-10-11-21-20(16-19)26-24(29)22(30-21)15-18-8-3-2-4-9-18/h2-4,8-11,15-17H,5-7,12-14H2,1H3,(H,25,28)(H,26,29)/t17-/m0/s1

InChI Key

QDBQYHHHPMSIHH-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD15108531

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.56

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.818

Distribution Coefficient, logD

2.585

Water Solubility, LogSw

-3.90

Polar Surface Area

52.532

Acid Dissociation Constant (pKa)

12.56

Base Dissociation Constant (pKb)

8.61

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with K788-9474 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K788-9474?
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What is the minimum amount of K788-9474 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K788-9474
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K788-9474
  • 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 K788-9474 available by request