V007-9135 Screening compound: N-[4-(4-tert-butylbenzamido)cyclohexyl]-2-[(2-fluorophenoxy)methyl]-1,3-thiazole-4-carboxamide

V007-9135 Screening compound: N-[4-(4-tert-butylbenzamido)cyclohexyl]-2-[(2-fluorophenoxy)methyl]-1,3-thiazole-4-carboxamide
V007-9135 Screening compound: N-[4-(4-tert-butylbenzamido)cyclohexyl]-2-[(2-fluorophenoxy)methyl]-1,3-thiazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-9135
N-[4-(4-tert-butylbenzamido)cyclohexyl]-2-[(2-fluorophenoxy)methyl]-1,3-thiazole-4-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

V007-9135

Molecular Formula

C28H32FN3O3S (C28 H32 FN3 O3 S)

Compound Name

N-[4-(4-tert-butylbenzamido)cyclohexyl]-2-[(2-fluorophenoxy)methyl]-1,3-thiazole-4-carboxamide

IUPAC name

N-[4-(4-tert-butylbenzamido)cyclohexyl]-2-[(2-fluorophenoxy)methyl]-13-thiazole-4-carboxamide

SMILES

CC(C)(C)c(cc1)ccc1C(NC(CC1)CCC1NC(c1csc(COc(cccc2)c2F)n1)=O)=O

InChI

InChI=1S/C28H32FN3O3S/c1-28(2,3)19-10-8-18(9-11-19)26(33)30-20-12-14-21(15-13-20)31-27(34)23-17-36-25(32-23)16-35-24-7-5-4-6-22(24)29/h4-11,17,20-21H,12-16H2,1-3H3,(H,30,33)(H,31,34)

InChI Key

AKJXJTGVLPUXDE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19968385

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

509.64

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.014

Distribution Coefficient, logD

6.014

Water Solubility, LogSw

-5.64

Polar Surface Area

66.139

Acid Dissociation Constant (pKa)

14.07

Base Dissociation Constant (pKb)

-0.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.30

V007-9135 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Anticancer Library (62698 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with V007-9135 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-9135?
Check Price and Availability of V007-9135, 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 V007-9135 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-9135
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-9135
  • 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 V007-9135 available by request