4567-2112 Screening compound: 2-[N-(4-ethoxyphenyl)methanesulfonamido]-N-[3-(trifluoromethyl)phenyl]propanamide

4567-2112 Screening compound: 2-[N-(4-ethoxyphenyl)methanesulfonamido]-N-[3-(trifluoromethyl)phenyl]propanamide
4567-2112 Screening compound: 2-[N-(4-ethoxyphenyl)methanesulfonamido]-N-[3-(trifluoromethyl)phenyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4567-2112
2-[N-(4-ethoxyphenyl)methanesulfonamido]-N-[3-(trifluoromethyl)phenyl]propanamide

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

4567-2112

Molecular Formula

C19H21F3N2O4S (C19 H21 F3 N2 O4 S)

Compound Name

2-[N-(4-ethoxyphenyl)methanesulfonamido]-N-[3-(trifluoromethyl)phenyl]propanamide

IUPAC name

2-[N-(4-ethoxyphenyl)methanesulfonamido]-N-[3-(trifluoromethyl)phenyl]propanamide

SMILES

CCOc(cc1)ccc1N(C(C)C(Nc1cc(C(F)(F)F)ccc1)=O)S(C)(=O)=O

InChI

InChI=1S/C19H21F3N2O4S/c1-4-28-17-10-8-16(9-11-17)24(29(3,26)27)13(2)18(25)23-15-7-5-6-14(12-15)19(20,21)22/h5-13H,4H2,1-3H3,(H,23,25)/t13-/m0/s1

InChI Key

LGIMCBFURJHBGV-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD03705413

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.055

Distribution Coefficient, logD

4.054

Water Solubility, LogSw

-4.03

Polar Surface Area

62.553

Acid Dissociation Constant (pKa)

10.07

Base Dissociation Constant (pKb)

-0.80

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.60

References: we are preparing a list of scientific research reports with 4567-2112 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4567-2112?
Check Price and Availability of 4567-2112, 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 4567-2112 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4567-2112
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4567-2112
  • 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 4567-2112 available by request