M569-0097 Screening compound: 2-(4-CHLOROPHENYL)-6-[(3,5-DIMETHYL-1H-PYRAZOL-4-YL)SULFONYL]-5,6,7,8-TETRAHYDROPYRIDO[4,3-D]PYRIMIDINE

M569-0097 Screening compound: 2-(4-CHLOROPHENYL)-6-[(3,5-DIMETHYL-1H-PYRAZOL-4-YL)SULFONYL]-5,6,7,8-TETRAHYDROPYRIDO[4,3-D]PYRIMIDINE
M569-0097 Screening compound: 2-(4-CHLOROPHENYL)-6-[(3,5-DIMETHYL-1H-PYRAZOL-4-YL)SULFONYL]-5,6,7,8-TETRAHYDROPYRIDO[4,3-D]PYRIMIDINE alternative view

Chemical Structure Depiction of ChemDiv screening compound M569-0097
2-(4-CHLOROPHENYL)-6-[(3,5-DIMETHYL-1H-PYRAZOL-4-YL)SULFONYL]-5,6,7,8-TETRAHYDROPYRIDO[4,3-D]PYRIMIDINE

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

M569-0097

Molecular Formula

C18H18ClN5O2S (C18 H18 ClN5 O2 S)

Compound Name

2-(4-CHLOROPHENYL)-6-[(3,5-DIMETHYL-1H-PYRAZOL-4-YL)SULFONYL]-5,6,7,8-TETRAHYDROPYRIDO[4,3-D]PYRIMIDINE

IUPAC name

n/a

SMILES

Cc([nH]nc1C)c1S(N(CC1)Cc2c1nc(-c(cc1)ccc1Cl)nc2)(=O)=O

InChI

InChI=1S/C18H18ClN5O2S/c1-11-17(12(2)23-22-11)27(25,26)24-8-7-16-14(10-24)9-20-18(21-16)13-3-5-15(19)6-4-13/h3-6,9H,7-8,10H2,1-2H3,(H,22,23)

InChI Key

HYVKIJLWZJHHQT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27547787

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.89

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.855

Distribution Coefficient, logD

2.855

Water Solubility, LogSw

-3.69

Polar Surface Area

75.848

Acid Dissociation Constant (pKa)

6.78

Base Dissociation Constant (pKb)

1.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

M569-0097 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antiviral Library (67538 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with M569-0097 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M569-0097?
Check Price and Availability of M569-0097, 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 M569-0097 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M569-0097
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M569-0097
  • 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 M569-0097 available by request