T479-0435 Screening compound: 3-methyl-N-{1-[5-(thiomorpholin-4-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}thiophene-2-carboxamide

T479-0435 Screening compound: 3-methyl-N-{1-[5-(thiomorpholin-4-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}thiophene-2-carboxamide
T479-0435 Screening compound: 3-methyl-N-{1-[5-(thiomorpholin-4-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}thiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound T479-0435
3-methyl-N-{1-[5-(thiomorpholin-4-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}thiophene-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

T479-0435

Molecular Formula

C17H18N6OS2 (C17 H18 N6 OS2)

Compound Name

3-methyl-N-{1-[5-(thiomorpholin-4-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}thiophene-2-carboxamide

IUPAC name

3-methyl-N-{1-[5-(thiomorpholin-4-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}thiophene-2-carboxamide

SMILES

Cc1c(C(Nc2cn(-c(ncnc3)c3N3CCSCC3)nc2)=O)scc1

InChI

InChI=1S/C17H18N6OS2/c1-12-2-5-26-15(12)17(24)21-13-8-20-23(10-13)16-14(9-18-11-19-16)22-3-6-25-7-4-22/h2,5,8-11H,3-4,6-7H2,1H3,(H,21,24)

InChI Key

ZJOKFASYDMEGRW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27621651

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.224

Distribution Coefficient, logD

2.223

Water Solubility, LogSw

-2.44

Polar Surface Area

62.070

Acid Dissociation Constant (pKa)

10.86

Base Dissociation Constant (pKb)

4.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

T479-0435 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system

References: we are preparing a list of scientific research reports with T479-0435 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T479-0435?
Check Price and Availability of T479-0435, 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 T479-0435 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T479-0435
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T479-0435
  • 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 T479-0435 available by request