C310-3046 Screening compound: (2Z)-N-[2-(4-chlorophenyl)ethyl]-4-methyl-3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide

C310-3046 Screening compound: (2Z)-N-[2-(4-chlorophenyl)ethyl]-4-methyl-3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
C310-3046 Screening compound: (2Z)-N-[2-(4-chlorophenyl)ethyl]-4-methyl-3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C310-3046
(2Z)-N-[2-(4-chlorophenyl)ethyl]-4-methyl-3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-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

C310-3046

Molecular Formula

C26H20ClF3N2O2S (C26 H20 ClF3 N2 O2 S)

Compound Name

(2Z)-N-[2-(4-chlorophenyl)ethyl]-4-methyl-3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide

IUPAC name

(2Z)-N-[2-(4-chlorophenyl)ethyl]-4-methyl-3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-34-dihydro-2H-14-benzothiazine-6-carboxamide

SMILES

CN(c(cc(cc1)C(NCCc(cc2)ccc2Cl)=O)c1S/C1=C\c2ccc(C(F)(F)F)cc2)C1=O

InChI

InChI=1S/C26H20ClF3N2O2S/c1-32-21-15-18(24(33)31-13-12-16-4-9-20(27)10-5-16)6-11-22(21)35-23(25(32)34)14-17-2-7-19(8-3-17)26(28,29)30/h2-11,14-15H,12-13H2,1H3,(H,31,33)

InChI Key

ZUCDQCNMAFRLPK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14747603

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

516.97

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.761

Distribution Coefficient, logD

5.761

Water Solubility, LogSw

-6.17

Polar Surface Area

39.362

Acid Dissociation Constant (pKa)

13.86

Base Dissociation Constant (pKb)

-2.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

References: we are preparing a list of scientific research reports with C310-3046 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C310-3046?
Check Price and Availability of C310-3046, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of C310-3046 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C310-3046
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C310-3046
  • 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 C310-3046 available by request