C310-2350 Screening compound: (2Z)-2-[(3,4-dimethoxyphenyl)methylidene]-6-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-4-methyl-3,4-dihydro-2H-1,4-benzothiazin-3-one

C310-2350 Screening compound: (2Z)-2-[(3,4-dimethoxyphenyl)methylidene]-6-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-4-methyl-3,4-dihydro-2H-1,4-benzothiazin-3-one
C310-2350 Screening compound: (2Z)-2-[(3,4-dimethoxyphenyl)methylidene]-6-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-4-methyl-3,4-dihydro-2H-1,4-benzothiazin-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C310-2350
(2Z)-2-[(3,4-dimethoxyphenyl)methylidene]-6-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-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

C310-2350

Molecular Formula

C31H33N3O4S (C31 H33 N3 O4 S)

Compound Name

(2Z)-2-[(3,4-dimethoxyphenyl)methylidene]-6-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-4-methyl-3,4-dihydro-2H-1,4-benzothiazin-3-one

IUPAC name

(2Z)-2-[(34-dimethoxyphenyl)methylidene]-6-[4-(25-dimethylphenyl)piperazine-1-carbonyl]-4-methyl-34-dihydro-2H-14-benzothiazin-3-one

SMILES

Cc1cc(N(CC2)CCN2C(c(cc2)cc(N(C)C3=O)c2S/C3=C\c(cc2)cc(OC)c2OC)=O)c(C)cc1

InChI

InChI=1S/C31H33N3O4S/c1-20-6-7-21(2)24(16-20)33-12-14-34(15-13-33)30(35)23-9-11-28-25(19-23)32(3)31(36)29(39-28)18-22-8-10-26(37-4)27(17-22)38-5/h6-11,16-19H,12-15H2,1-5H3

InChI Key

CQMHPKDIPHKQHP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14747421

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

543.69

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.082

Distribution Coefficient, logD

5.082

Water Solubility, LogSw

-4.88

Polar Surface Area

49.975

Acid Dissociation Constant (pKa)

28.39

Base Dissociation Constant (pKb)

4.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.00

References: we are preparing a list of scientific research reports with C310-2350 chemical compound. It will be published here after verification.

Frequently Asked Questions

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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C310-2350
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C310-2350
  • 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 C310-2350 available by request