V021-5176 Screening compound: N-{3-[3-(2-ethoxyethoxy)-5-(4-methylphenyl)-1H-1,2,4-triazol-1-yl]phenyl}-3-methoxybenzamide

V021-5176 Screening compound: N-{3-[3-(2-ethoxyethoxy)-5-(4-methylphenyl)-1H-1,2,4-triazol-1-yl]phenyl}-3-methoxybenzamide
V021-5176 Screening compound: N-{3-[3-(2-ethoxyethoxy)-5-(4-methylphenyl)-1H-1,2,4-triazol-1-yl]phenyl}-3-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-5176
N-{3-[3-(2-ethoxyethoxy)-5-(4-methylphenyl)-1H-1,2,4-triazol-1-yl]phenyl}-3-methoxybenzamide

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

V021-5176

Molecular Formula

C27H28N4O4 (C27 H28 N4 O4)

Compound Name

N-{3-[3-(2-ethoxyethoxy)-5-(4-methylphenyl)-1H-1,2,4-triazol-1-yl]phenyl}-3-methoxybenzamide

IUPAC name

N-{3-[3-(2-ethoxyethoxy)-5-(4-methylphenyl)-1H-124-triazol-1-yl]phenyl}-3-methoxybenzamide

SMILES

CCOCCOc(nc1-c2ccc(C)cc2)nn1-c1cccc(NC(c2cc(OC)ccc2)=O)c1

InChI

InChI=1S/C27H28N4O4/c1-4-34-15-16-35-27-29-25(20-13-11-19(2)12-14-20)31(30-27)23-9-6-8-22(18-23)28-26(32)21-7-5-10-24(17-21)33-3/h5-14,17-18H,4,15-16H2,1-3H3,(H,28,32)

InChI Key

DLTSEAPMUDOFHO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19784061

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

472.54

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.572

Distribution Coefficient, logD

5.572

Water Solubility, LogSw

-5.38

Polar Surface Area

69.720

Acid Dissociation Constant (pKa)

12.39

Base Dissociation Constant (pKb)

1.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

References: we are preparing a list of scientific research reports with V021-5176 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-5176?
Check Price and Availability of V021-5176, 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 V021-5176 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-5176
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-5176
  • 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 V021-5176 available by request