T202-0883 Screening compound: 2-(3,4-dimethoxyphenyl)-5-(2-thienylmethyl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine

T202-0883 Screening compound: 2-(3,4-dimethoxyphenyl)-5-(2-thienylmethyl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine
T202-0883 Screening compound: 2-(3,4-dimethoxyphenyl)-5-(2-thienylmethyl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine alternative view

Chemical Structure Depiction of ChemDiv screening compound T202-0883
2-(3,4-dimethoxyphenyl)-5-(2-thienylmethyl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine

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

T202-0883

Molecular Formula

C20H23N3O2S (C20 H23 N3 O2 S)

Compound Name

2-(3,4-dimethoxyphenyl)-5-(2-thienylmethyl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine

IUPAC name

2-(34-dimethoxyphenyl)-5-[(thiophen-2-yl)methyl]-4H5H6H7H8H-pyrazolo[15-a][14]diazepine

SMILES

COc(ccc(-c1nn(CCCN(Cc2cccs2)C2)c2c1)c1)c1OC

InChI

InChI=1S/C20H23N3O2S/c1-24-19-7-6-15(11-20(19)25-2)18-12-16-13-22(8-4-9-23(16)21-18)14-17-5-3-10-26-17/h3,5-7,10-12H,4,8-9,13-14H2,1-2H3

InChI Key

QHBCLEZSZWKNOA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27618725

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

369.49

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.113

Distribution Coefficient, logD

3.049

Water Solubility, LogSw

-3.10

Polar Surface Area

33.781

Acid Dissociation Constant (pKa)

26.76

Base Dissociation Constant (pKb)

6.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

T202-0883 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

Hsp90-Targeted Library (11355 compounds)

Protein-Protein Interaction Library (218420 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with T202-0883 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T202-0883?
Check Price and Availability of T202-0883, 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 T202-0883 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T202-0883
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T202-0883
  • 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 T202-0883 available by request