C310-2090 Screening compound: (2Z)-4-methyl-6-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]-2-[(3-methylphenyl)methylidene]-3,4-dihydro-2H-1,4-benzothiazin-3-one

C310-2090 Screening compound: (2Z)-4-methyl-6-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]-2-[(3-methylphenyl)methylidene]-3,4-dihydro-2H-1,4-benzothiazin-3-one
C310-2090 Screening compound: (2Z)-4-methyl-6-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]-2-[(3-methylphenyl)methylidene]-3,4-dihydro-2H-1,4-benzothiazin-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C310-2090
(2Z)-4-methyl-6-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]-2-[(3-methylphenyl)methylidene]-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

C310-2090

Molecular Formula

C30H31N3O2S (C30 H31 N3 O2 S)

Compound Name

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

IUPAC name

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

SMILES

CC(CN(CC1)C(c(cc2)cc(N(C)C3=O)c2S/C3=C\c2cc(C)ccc2)=O)N1c1cc(C)ccc1

InChI

InChI=1S/C30H31N3O2S/c1-20-7-5-9-23(15-20)17-28-30(35)31(4)26-18-24(11-12-27(26)36-28)29(34)32-13-14-33(22(3)19-32)25-10-6-8-21(2)16-25/h5-12,15-18,22H,13-14,19H2,1-4H3/t22-/m0/s1

InChI Key

WMWBUWKBWGEELL-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD14747316

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

497.66

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.680

Distribution Coefficient, logD

5.680

Water Solubility, LogSw

-5.34

Polar Surface Area

34.234

Acid Dissociation Constant (pKa)

26.03

Base Dissociation Constant (pKb)

2.51

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.70

References: we are preparing a list of scientific research reports with C310-2090 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C310-2090?
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What is the minimum amount of C310-2090 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C310-2090
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C310-2090
  • 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 C310-2090 available by request