8009-0680 Screening compound: 4-(4-cyclohexylphenyl)-N-(4-phenoxyphenyl)-1,3-thiazol-2-amine

8009-0680 Screening compound: 4-(4-cyclohexylphenyl)-N-(4-phenoxyphenyl)-1,3-thiazol-2-amine
8009-0680 Screening compound: 4-(4-cyclohexylphenyl)-N-(4-phenoxyphenyl)-1,3-thiazol-2-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-0680
4-(4-cyclohexylphenyl)-N-(4-phenoxyphenyl)-1,3-thiazol-2-amine

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

8009-0680

Molecular Formula

C27H26N2OS (C27 H26 N2 OS)

Compound Name

4-(4-cyclohexylphenyl)-N-(4-phenoxyphenyl)-1,3-thiazol-2-amine

IUPAC name

4-(4-cyclohexylphenyl)-N-(4-phenoxyphenyl)-13-thiazol-2-amine

SMILES

C(CC1)CCC1c(cc1)ccc1-c1csc(Nc(cc2)ccc2Oc2ccccc2)n1

InChI

InChI=1S/C27H26N2OS/c1-3-7-20(8-4-1)21-11-13-22(14-12-21)26-19-31-27(29-26)28-23-15-17-25(18-16-23)30-24-9-5-2-6-10-24/h2,5-6,9-20H,1,3-4,7-8H2,(H,28,29)

InChI Key

AWXAJFGOFLKFKB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01461001

Chemical and Physical Properties

Saltdata

HBr

Molecular Weight

426.58

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

9.320

Distribution Coefficient, logD

9.320

Water Solubility, LogSw

-6.30

Polar Surface Area

25.594

Acid Dissociation Constant (pKa)

20.52

Base Dissociation Constant (pKb)

3.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

8009-0680 in Drug Discovery

Included in Screening Libraries

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

Epigenetics Focused Set (26518 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8009-0680 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-0680?
Check Price and Availability of 8009-0680, 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 8009-0680 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-0680
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-0680
  • 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 8009-0680 available by request