V025-0081 Screening compound: N-{3-[3-ethoxy-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}-3-methoxybenzamide

V025-0081 Screening compound: N-{3-[3-ethoxy-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}-3-methoxybenzamide
V025-0081 Screening compound: N-{3-[3-ethoxy-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}-3-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V025-0081
N-{3-[3-ethoxy-5-(thiophen-2-yl)-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

V025-0081

Molecular Formula

C22H20N4O3S (C22 H20 N4 O3 S)

Compound Name

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

IUPAC name

N-{3-[3-ethoxy-5-(thiophen-2-yl)-1H-124-triazol-1-yl]phenyl}-3-methoxybenzamide

SMILES

CCOc(nc1-c2cccs2)nn1-c1cc(NC(c2cc(OC)ccc2)=O)ccc1

InChI

InChI=1S/C22H20N4O3S/c1-3-29-22-24-20(19-11-6-12-30-19)26(25-22)17-9-5-8-16(14-17)23-21(27)15-7-4-10-18(13-15)28-2/h4-14H,3H2,1-2H3,(H,23,27)

InChI Key

DWGLWCMRXBBRQE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19793642

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

420.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.170

Distribution Coefficient, logD

5.170

Water Solubility, LogSw

-5.01

Polar Surface Area

62.467

Acid Dissociation Constant (pKa)

12.39

Base Dissociation Constant (pKb)

1.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

References: we are preparing a list of scientific research reports with V025-0081 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V025-0081?
Check Price and Availability of V025-0081, 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 V025-0081 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V025-0081
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V025-0081
  • 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 V025-0081 available by request