T479-0376 Screening compound: N~2~-[1-(5-morpholino-4-pyrimidinyl)-1H-pyrazol-4-yl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

T479-0376 Screening compound: N~2~-[1-(5-morpholino-4-pyrimidinyl)-1H-pyrazol-4-yl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
T479-0376 Screening compound: N~2~-[1-(5-morpholino-4-pyrimidinyl)-1H-pyrazol-4-yl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound T479-0376
N~2~-[1-(5-morpholino-4-pyrimidinyl)-1H-pyrazol-4-yl]-4,5,6,7-tetrahydro-1-benzothiophene-2-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

T479-0376

Molecular Formula

C20H22N6O2S (C20 H22 N6 O2 S)

Compound Name

N~2~-[1-(5-morpholino-4-pyrimidinyl)-1H-pyrazol-4-yl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

IUPAC name

n/a

SMILES

O=C(c1cc(CCCC2)c2s1)Nc1cn(-c2ncncc2N2CCOCC2)nc1

InChI

InChI=1S/C20H22N6O2S/c27-20(18-9-14-3-1-2-4-17(14)29-18)24-15-10-23-26(12-15)19-16(11-21-13-22-19)25-5-7-28-8-6-25/h9-13H,1-8H2,(H,24,27)

InChI Key

DIUWETZIAAJOPI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27621635

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.614

Distribution Coefficient, logD

2.613

Water Solubility, LogSw

-3.05

Polar Surface Area

69.899

Acid Dissociation Constant (pKa)

11.76

Base Dissociation Constant (pKb)

4.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

T479-0376 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with T479-0376 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T479-0376?
Check Price and Availability of T479-0376, 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 T479-0376 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T479-0376
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T479-0376
  • 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 T479-0376 available by request