V010-0114 Screening compound: N-(3-{3-ethoxy-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-2-methylpropanamide

V010-0114 Screening compound: N-(3-{3-ethoxy-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-2-methylpropanamide
V010-0114 Screening compound: N-(3-{3-ethoxy-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-2-methylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V010-0114
N-(3-{3-ethoxy-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-2-methylpropanamide

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

V010-0114

Molecular Formula

C21H21F3N4O2 (C21 H21 F3 N4 O2)

Compound Name

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

IUPAC name

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

SMILES

CCOc(nc1-c2ccc(C(F)(F)F)cc2)nn1-c1cc(NC(C(C)C)=O)ccc1

InChI

InChI=1S/C21H21F3N4O2/c1-4-30-20-26-18(14-8-10-15(11-9-14)21(22,23)24)28(27-20)17-7-5-6-16(12-17)25-19(29)13(2)3/h5-13H,4H2,1-3H3,(H,25,29)

InChI Key

GDOFMWUQISVTEM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19780698

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

418.42

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.600

Distribution Coefficient, logD

5.600

Water Solubility, LogSw

-5.40

Polar Surface Area

54.176

Acid Dissociation Constant (pKa)

13.04

Base Dissociation Constant (pKb)

2.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with V010-0114 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V010-0114?
Check Price and Availability of V010-0114, 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 V010-0114 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V010-0114
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V010-0114
  • 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 V010-0114 available by request