J029-0670 Screening compound: N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-1-phenylcyclopentane-1-carboxamide

J029-0670 Screening compound: N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-1-phenylcyclopentane-1-carboxamide
J029-0670 Screening compound: N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-1-phenylcyclopentane-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound J029-0670
N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-1-phenylcyclopentane-1-carboxamide

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

J029-0670

Molecular Formula

C23H24N2O3S (C23 H24 N2 O3 S)

Compound Name

N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-1-phenylcyclopentane-1-carboxamide

IUPAC name

N-[4-(34-dimethoxyphenyl)-13-thiazol-2-yl]-1-phenylcyclopentane-1-carboxamide

SMILES

COc(ccc(-c1csc(NC(C2(CCCC2)c2ccccc2)=O)n1)c1)c1OC

InChI

InChI=1S/C23H24N2O3S/c1-27-19-11-10-16(14-20(19)28-2)18-15-29-22(24-18)25-21(26)23(12-6-7-13-23)17-8-4-3-5-9-17/h3-5,8-11,14-15H,6-7,12-13H2,1-2H3,(H,24,25,26)

InChI Key

KXCRMWKJFXYHNU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD11855541

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.52

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.359

Distribution Coefficient, logD

5.358

Water Solubility, LogSw

-5.34

Polar Surface Area

48.652

Acid Dissociation Constant (pKa)

10.23

Base Dissociation Constant (pKb)

0.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

J029-0670 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Angiogenesis library (14822 compounds)

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

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with J029-0670 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J029-0670?
Check Price and Availability of J029-0670, 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 J029-0670 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J029-0670
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J029-0670
  • 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 J029-0670 available by request