E141-0233 Screening compound: N-(3-fluorophenyl)-5-methyl-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxamide

E141-0233 Screening compound: N-(3-fluorophenyl)-5-methyl-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxamide
E141-0233 Screening compound: N-(3-fluorophenyl)-5-methyl-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E141-0233
N-(3-fluorophenyl)-5-methyl-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-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

E141-0233

Molecular Formula

C17H12F4N4O (C17 H12 F4 N4 O)

Compound Name

N-(3-fluorophenyl)-5-methyl-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxamide

IUPAC name

N-(3-fluorophenyl)-5-methyl-1-[3-(trifluoromethyl)phenyl]-1H-123-triazole-4-carboxamide

SMILES

Cc1c(C(Nc2cccc(F)c2)=O)nnn1-c1cc(C(F)(F)F)ccc1

InChI

InChI=1S/C17H12F4N4O/c1-10-15(16(26)22-13-6-3-5-12(18)9-13)23-24-25(10)14-7-2-4-11(8-14)17(19,20)21/h2-9H,1H3,(H,22,26)

InChI Key

IYDGKWCDDXCXML-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14842011

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.3

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.876

Distribution Coefficient, logD

3.870

Water Solubility, LogSw

-4.07

Polar Surface Area

50.173

Acid Dissociation Constant (pKa)

9.33

Base Dissociation Constant (pKb)

-0.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

References: we are preparing a list of scientific research reports with E141-0233 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E141-0233?
Check Price and Availability of E141-0233, 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 E141-0233 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E141-0233
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E141-0233
  • 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 E141-0233 available by request