E470-1089 Screening compound: 4-acetyl-2-methyl-N~6~-(3-pyridylmethyl)-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide

E470-1089 Screening compound: 4-acetyl-2-methyl-N~6~-(3-pyridylmethyl)-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
E470-1089 Screening compound: 4-acetyl-2-methyl-N~6~-(3-pyridylmethyl)-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E470-1089
4-acetyl-2-methyl-N~6~-(3-pyridylmethyl)-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide

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

E470-1089

Molecular Formula

C17H19N3O3S2 (C17 H19 N3 O3 S2)

Compound Name

4-acetyl-2-methyl-N~6~-(3-pyridylmethyl)-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide

IUPAC name

4-acetyl-2-methyl-N-[(pyridin-3-yl)methyl]-34-dihydro-2H-14-benzothiazine-6-sulfonamide

SMILES

CC(C1)Sc(ccc(S(NCc2cnccc2)(=O)=O)c2)c2N1C(C)=O

InChI

InChI=1S/C17H19N3O3S2/c1-12-11-20(13(2)21)16-8-15(5-6-17(16)24-12)25(22,23)19-10-14-4-3-7-18-9-14/h3-9,12,19H,10-11H2,1-2H3/t12-/m1/s1

InChI Key

DJCVGLGYLGPHSB-GFCCVEGCSA-N

MDL Number (MFCD)

MFCD14854918

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.49

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.889

Distribution Coefficient, logD

1.888

Water Solubility, LogSw

-2.16

Polar Surface Area

67.500

Acid Dissociation Constant (pKa)

9.81

Base Dissociation Constant (pKb)

3.97

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.41

References: we are preparing a list of scientific research reports with E470-1089 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E470-1089?
Check Price and Availability of E470-1089, 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 E470-1089 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E470-1089
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E470-1089
  • 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 E470-1089 available by request