Z217-1247 Screening compound: 1-(AZEPAN-1-YL)-2-{METHYL[3-METHYL-1-(3-METHYLPHENYL)-1H-PYRAZOLO[3,4-D][1,3]THIAZOL-5-YL]AMINO}ETHAN-1-ONE

Z217-1247 Screening compound: 1-(AZEPAN-1-YL)-2-{METHYL[3-METHYL-1-(3-METHYLPHENYL)-1H-PYRAZOLO[3,4-D][1,3]THIAZOL-5-YL]AMINO}ETHAN-1-ONE
Z217-1247 Screening compound: 1-(AZEPAN-1-YL)-2-{METHYL[3-METHYL-1-(3-METHYLPHENYL)-1H-PYRAZOLO[3,4-D][1,3]THIAZOL-5-YL]AMINO}ETHAN-1-ONE alternative view

Chemical Structure Depiction of ChemDiv screening compound Z217-1247
1-(AZEPAN-1-YL)-2-{METHYL[3-METHYL-1-(3-METHYLPHENYL)-1H-PYRAZOLO[3,4-D][1,3]THIAZOL-5-YL]AMINO}ETHAN-1-ONE

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

Z217-1247

Molecular Formula

C21H27N5OS (C21 H27 N5 OS)

Compound Name

1-(AZEPAN-1-YL)-2-{METHYL[3-METHYL-1-(3-METHYLPHENYL)-1H-PYRAZOLO[3,4-D][1,3]THIAZOL-5-YL]AMINO}ETHAN-1-ONE

IUPAC name

1-(azepan-1-yl)-2-{methyl[3-methyl-1-(3-methylphenyl)-1H-pyrazolo[34-d][13]thiazol-5-yl]amino}ethan-1-one

SMILES

Cc(c1c2nc(N(C)CC(N3CCCCCC3)=O)s1)nn2-c1cc(C)ccc1

InChI

InChI=1S/C21H27N5OS/c1-15-9-8-10-17(13-15)26-20-19(16(2)23-26)28-21(22-20)24(3)14-18(27)25-11-6-4-5-7-12-25/h8-10,13H,4-7,11-12,14H2,1-3H3

InChI Key

NVQBVSBACBCEDW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27634743

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.54

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.104

Distribution Coefficient, logD

4.104

Water Solubility, LogSw

-4.18

Polar Surface Area

44.517

Acid Dissociation Constant (pKa)

17.18

Base Dissociation Constant (pKb)

3.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.62

Z217-1247 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Z217-1247 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Z217-1247?
Check Price and Availability of Z217-1247, 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 Z217-1247 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Z217-1247
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Z217-1247
  • 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 Z217-1247 available by request