Z301-0622 Screening compound: 1-(2-chloro-4-fluorobenzoyl)-4-[3-methyl-1-(3-methylphenyl)-1H-pyrazolo[3,4-d][1,3]thiazol-5-yl]-1,4-diazepane

Z301-0622 Screening compound: 1-(2-chloro-4-fluorobenzoyl)-4-[3-methyl-1-(3-methylphenyl)-1H-pyrazolo[3,4-d][1,3]thiazol-5-yl]-1,4-diazepane
Z301-0622 Screening compound: 1-(2-chloro-4-fluorobenzoyl)-4-[3-methyl-1-(3-methylphenyl)-1H-pyrazolo[3,4-d][1,3]thiazol-5-yl]-1,4-diazepane alternative view

Chemical Structure Depiction of ChemDiv screening compound Z301-0622
1-(2-chloro-4-fluorobenzoyl)-4-[3-methyl-1-(3-methylphenyl)-1H-pyrazolo[3,4-d][1,3]thiazol-5-yl]-1,4-diazepane

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

Z301-0622

Molecular Formula

C24H23ClFN5OS (C24 H23 ClFN5 OS)

Compound Name

1-(2-chloro-4-fluorobenzoyl)-4-[3-methyl-1-(3-methylphenyl)-1H-pyrazolo[3,4-d][1,3]thiazol-5-yl]-1,4-diazepane

IUPAC name

1-(2-chloro-4-fluorobenzoyl)-4-[3-methyl-1-(3-methylphenyl)-1H-pyrazolo[34-d][13]thiazol-5-yl]-14-diazepane

SMILES

Cc(c1c2nc(N(CCC3)CCN3C(c(ccc(F)c3)c3Cl)=O)s1)nn2-c1cc(C)ccc1

InChI

InChI=1S/C24H23ClFN5OS/c1-15-5-3-6-18(13-15)31-22-21(16(2)28-31)33-24(27-22)30-10-4-9-29(11-12-30)23(32)19-8-7-17(26)14-20(19)25/h3,5-8,13-14H,4,9-12H2,1-2H3

InChI Key

PTRXBVPFXVWUBH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27638383

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

484

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.280

Distribution Coefficient, logD

5.280

Water Solubility, LogSw

-5.86

Polar Surface Area

45.078

Acid Dissociation Constant (pKa)

23.18

Base Dissociation Constant (pKb)

0.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

Z301-0622 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

KRAS-Targeted Library (16000 compounds)

Protein-Protein Interaction Library (218420 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with Z301-0622 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Z301-0622?
Check Price and Availability of Z301-0622, 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 Z301-0622 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Z301-0622
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Z301-0622
  • 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 Z301-0622 available by request