C306-0575 Screening compound: (2Z)-2-{2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethylidene}-3,4-dihydro-2H-1,4-benzothiazin-3-one

C306-0575 Screening compound: (2Z)-2-{2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethylidene}-3,4-dihydro-2H-1,4-benzothiazin-3-one
C306-0575 Screening compound: (2Z)-2-{2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethylidene}-3,4-dihydro-2H-1,4-benzothiazin-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C306-0575
(2Z)-2-{2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethylidene}-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

C306-0575

Molecular Formula

C22H23N3O2S (C22 H23 N3 O2 S)

Compound Name

(2Z)-2-{2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethylidene}-3,4-dihydro-2H-1,4-benzothiazin-3-one

IUPAC name

(2Z)-2-{2-[4-(25-dimethylphenyl)piperazin-1-yl]-2-oxoethylidene}-34-dihydro-2H-14-benzothiazin-3-one

SMILES

Cc1cc(N(CC2)CCN2C(/C=C2\Sc(cccc3)c3NC2=O)=O)c(C)cc1

InChI

InChI=1S/C22H23N3O2S/c1-15-7-8-16(2)18(13-15)24-9-11-25(12-10-24)21(26)14-20-22(27)23-17-5-3-4-6-19(17)28-20/h3-8,13-14H,9-12H2,1-2H3,(H,23,27)

InChI Key

JRLMRFYMADQLNH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14746859

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.984

Distribution Coefficient, logD

3.983

Water Solubility, LogSw

-4.03

Polar Surface Area

44.196

Acid Dissociation Constant (pKa)

12.76

Base Dissociation Constant (pKb)

3.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

References: we are preparing a list of scientific research reports with C306-0575 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C306-0575?
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What is the minimum amount of C306-0575 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C306-0575
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C306-0575
  • 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 C306-0575 available by request