C310-2756 Screening compound: (2Z)-6-(4-benzylpiperazine-1-carbonyl)-2-[(3-methoxyphenyl)methylidene]-4-methyl-3,4-dihydro-2H-1,4-benzothiazin-3-one

C310-2756 Screening compound: (2Z)-6-(4-benzylpiperazine-1-carbonyl)-2-[(3-methoxyphenyl)methylidene]-4-methyl-3,4-dihydro-2H-1,4-benzothiazin-3-one
C310-2756 Screening compound: (2Z)-6-(4-benzylpiperazine-1-carbonyl)-2-[(3-methoxyphenyl)methylidene]-4-methyl-3,4-dihydro-2H-1,4-benzothiazin-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C310-2756
(2Z)-6-(4-benzylpiperazine-1-carbonyl)-2-[(3-methoxyphenyl)methylidene]-4-methyl-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

C310-2756

Molecular Formula

C29H29N3O3S (C29 H29 N3 O3 S)

Compound Name

(2Z)-6-(4-benzylpiperazine-1-carbonyl)-2-[(3-methoxyphenyl)methylidene]-4-methyl-3,4-dihydro-2H-1,4-benzothiazin-3-one

IUPAC name

(2Z)-6-(4-benzylpiperazine-1-carbonyl)-2-[(3-methoxyphenyl)methylidene]-4-methyl-34-dihydro-2H-14-benzothiazin-3-one

SMILES

CN(c(cc(cc1)C(N2CCN(Cc3ccccc3)CC2)=O)c1S/C1=C\c2cc(OC)ccc2)C1=O

InChI

InChI=1S/C29H29N3O3S/c1-30-25-19-23(28(33)32-15-13-31(14-16-32)20-21-7-4-3-5-8-21)11-12-26(25)36-27(29(30)34)18-22-9-6-10-24(17-22)35-2/h3-12,17-19H,13-16,20H2,1-2H3

InChI Key

XDMBIYBMPJFGRW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14747548

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

499.63

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.963

Distribution Coefficient, logD

3.948

Water Solubility, LogSw

-4.18

Polar Surface Area

42.839

Acid Dissociation Constant (pKa)

28.54

Base Dissociation Constant (pKb)

5.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.10

References: we are preparing a list of scientific research reports with C310-2756 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C310-2756?
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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C310-2756
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C310-2756
  • 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 C310-2756 available by request