Z217-1181 Screening compound: N-[(3,4-diethoxyphenyl)methyl]-2-[methyl({3-methyl-1-phenyl-1H-pyrazolo[3,4-d][1,3]thiazol-5-yl})amino]acetamide

Z217-1181 Screening compound: N-[(3,4-diethoxyphenyl)methyl]-2-[methyl({3-methyl-1-phenyl-1H-pyrazolo[3,4-d][1,3]thiazol-5-yl})amino]acetamide
Z217-1181 Screening compound: N-[(3,4-diethoxyphenyl)methyl]-2-[methyl({3-methyl-1-phenyl-1H-pyrazolo[3,4-d][1,3]thiazol-5-yl})amino]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Z217-1181
N-[(3,4-diethoxyphenyl)methyl]-2-[methyl({3-methyl-1-phenyl-1H-pyrazolo[3,4-d][1,3]thiazol-5-yl})amino]acetamide

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

Z217-1181

Molecular Formula

C25H29N5O3S (C25 H29 N5 O3 S)

Compound Name

N-[(3,4-diethoxyphenyl)methyl]-2-[methyl({3-methyl-1-phenyl-1H-pyrazolo[3,4-d][1,3]thiazol-5-yl})amino]acetamide

IUPAC name

N-[(34-diethoxyphenyl)methyl]-2-[methyl({3-methyl-1-phenyl-1H-pyrazolo[34-d][13]thiazol-5-yl})amino]acetamide

SMILES

CCOc(ccc(CNC(CN(C)c1nc(n(-c2ccccc2)nc2C)c2s1)=O)c1)c1OCC

InChI

InChI=1S/C25H29N5O3S/c1-5-32-20-13-12-18(14-21(20)33-6-2)15-26-22(31)16-29(4)25-27-24-23(34-25)17(3)28-30(24)19-10-8-7-9-11-19/h7-14H,5-6,15-16H2,1-4H3,(H,26,31)

InChI Key

MQJMTHPMMHEMCA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27634717

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.6

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.728

Distribution Coefficient, logD

3.728

Water Solubility, LogSw

-3.88

Polar Surface Area

66.685

Acid Dissociation Constant (pKa)

14.62

Base Dissociation Constant (pKb)

1.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.00

Z217-1181 in Drug Discovery

Included in Screening Libraries

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

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with Z217-1181 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Z217-1181?
Check Price and Availability of Z217-1181, 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 Z217-1181 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Z217-1181
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Z217-1181
  • 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 Z217-1181 available by request