E966-1477 Screening compound: 1-[(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl)sulfonyl]-N~4~-(3-pyridyl)-4-piperidinecarboxamide

E966-1477 Screening compound: 1-[(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl)sulfonyl]-N~4~-(3-pyridyl)-4-piperidinecarboxamide
E966-1477 Screening compound: 1-[(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl)sulfonyl]-N~4~-(3-pyridyl)-4-piperidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E966-1477
1-[(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl)sulfonyl]-N~4~-(3-pyridyl)-4-piperidinecarboxamide

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

E966-1477

Molecular Formula

C20H22N4O4S2 (C20 H22 N4 O4 S2)

Compound Name

1-[(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl)sulfonyl]-N~4~-(3-pyridyl)-4-piperidinecarboxamide

IUPAC name

n/a

SMILES

CC1Sc(ccc(S(N(CC2)CCC2C(Nc2cnccc2)=O)(=O)=O)c2)c2NC1=O

InChI

InChI=1S/C20H22N4O4S2/c1-13-19(25)23-17-11-16(4-5-18(17)29-13)30(27,28)24-9-6-14(7-10-24)20(26)22-15-3-2-8-21-12-15/h2-5,8,11-14H,6-7,9-10H2,1H3,(H,22,26)(H,23,25)/t13-/m1/s1

InChI Key

OGTXSPDUUFSXJQ-CYBMUJFWSA-N

MDL Number (MFCD)

MFCD14933861

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.55

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.804

Distribution Coefficient, logD

1.803

Water Solubility, LogSw

-2.19

Polar Surface Area

89.436

Acid Dissociation Constant (pKa)

11.66

Base Dissociation Constant (pKb)

3.88

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.00

E966-1477 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Targeted Diversity Library (40567 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with E966-1477 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E966-1477?
Check Price and Availability of E966-1477, 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 E966-1477 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E966-1477
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E966-1477
  • 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 E966-1477 available by request