T200-0664 Screening compound: 1-[2-(4-ethoxyphenyl)-4H,5H,6H,7H,8H-pyrazolo[1,5-a][1,4]diazepin-5-yl]-2-(thiophen-3-yl)ethan-1-one

T200-0664 Screening compound: 1-[2-(4-ethoxyphenyl)-4H,5H,6H,7H,8H-pyrazolo[1,5-a][1,4]diazepin-5-yl]-2-(thiophen-3-yl)ethan-1-one
T200-0664 Screening compound: 1-[2-(4-ethoxyphenyl)-4H,5H,6H,7H,8H-pyrazolo[1,5-a][1,4]diazepin-5-yl]-2-(thiophen-3-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound T200-0664
1-[2-(4-ethoxyphenyl)-4H,5H,6H,7H,8H-pyrazolo[1,5-a][1,4]diazepin-5-yl]-2-(thiophen-3-yl)ethan-1-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

T200-0664

Molecular Formula

C21H23N3O2S (C21 H23 N3 O2 S)

Compound Name

1-[2-(4-ethoxyphenyl)-4H,5H,6H,7H,8H-pyrazolo[1,5-a][1,4]diazepin-5-yl]-2-(thiophen-3-yl)ethan-1-one

IUPAC name

1-[2-(4-ethoxyphenyl)-4H5H6H7H8H-pyrazolo[15-a][14]diazepin-5-yl]-2-(thiophen-3-yl)ethan-1-one

SMILES

CCOc(cc1)ccc1-c1nn(CCCN(C2)C(Cc3cscc3)=O)c2c1

InChI

InChI=1S/C21H23N3O2S/c1-2-26-19-6-4-17(5-7-19)20-13-18-14-23(9-3-10-24(18)22-20)21(25)12-16-8-11-27-15-16/h4-8,11,13,15H,2-3,9-10,12,14H2,1H3

InChI Key

ICLDFRNNGDGMMI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27618635

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.5

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.735

Distribution Coefficient, logD

3.735

Water Solubility, LogSw

-3.89

Polar Surface Area

38.032

Acid Dissociation Constant (pKa)

18.49

Base Dissociation Constant (pKb)

-0.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

T200-0664 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics
  • Cyclic compounds
  • Mimetics

References: we are preparing a list of scientific research reports with T200-0664 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T200-0664?
Check Price and Availability of T200-0664, 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 T200-0664 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T200-0664
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T200-0664
  • 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 T200-0664 available by request