V015-2245 Screening compound: N-{4-[5-(4-methoxyphenyl)-3-[2-(4-methoxyphenyl)ethoxy]-1H-1,2,4-triazol-1-yl]phenyl}-3-methylbutanamide

V015-2245 Screening compound: N-{4-[5-(4-methoxyphenyl)-3-[2-(4-methoxyphenyl)ethoxy]-1H-1,2,4-triazol-1-yl]phenyl}-3-methylbutanamide
V015-2245 Screening compound: N-{4-[5-(4-methoxyphenyl)-3-[2-(4-methoxyphenyl)ethoxy]-1H-1,2,4-triazol-1-yl]phenyl}-3-methylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V015-2245
N-{4-[5-(4-methoxyphenyl)-3-[2-(4-methoxyphenyl)ethoxy]-1H-1,2,4-triazol-1-yl]phenyl}-3-methylbutanamide

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

V015-2245

Molecular Formula

C29H32N4O4 (C29 H32 N4 O4)

Compound Name

N-{4-[5-(4-methoxyphenyl)-3-[2-(4-methoxyphenyl)ethoxy]-1H-1,2,4-triazol-1-yl]phenyl}-3-methylbutanamide

IUPAC name

N-{4-[5-(4-methoxyphenyl)-3-[2-(4-methoxyphenyl)ethoxy]-1H-124-triazol-1-yl]phenyl}-3-methylbutanamide

SMILES

CC(C)CC(Nc(cc1)ccc1-n(c(-c(cc1)ccc1OC)n1)nc1OCCc(cc1)ccc1OC)=O

InChI

InChI=1S/C29H32N4O4/c1-20(2)19-27(34)30-23-9-11-24(12-10-23)33-28(22-7-15-26(36-4)16-8-22)31-29(32-33)37-18-17-21-5-13-25(35-3)14-6-21/h5-16,20H,17-19H2,1-4H3,(H,30,34)

InChI Key

XKYCOBPCRXVLQX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19783773

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

500.6

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

6.391

Distribution Coefficient, logD

6.391

Water Solubility, LogSw

-5.74

Polar Surface Area

69.073

Acid Dissociation Constant (pKa)

12.20

Base Dissociation Constant (pKb)

0.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.60

V015-2245 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with V015-2245 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V015-2245?
Check Price and Availability of V015-2245, 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 V015-2245 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V015-2245
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V015-2245
  • 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 V015-2245 available by request