1658-0064 Screening compound: N~1~-[2-acetyl-5-(tert-butyl)phenyl]benzamide

1658-0064 Screening compound: N~1~-[2-acetyl-5-(tert-butyl)phenyl]benzamide
1658-0064 Screening compound: N~1~-[2-acetyl-5-(tert-butyl)phenyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1658-0064
N~1~-[2-acetyl-5-(tert-butyl)phenyl]benzamide

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

1658-0064

Molecular Formula

C19H21NO2 (C19 H21 NO2)

Compound Name

N~1~-[2-acetyl-5-(tert-butyl)phenyl]benzamide

IUPAC name

N-(2-acetyl-5-tert-butylphenyl)benzamide

SMILES

CC(C)(C)c(cc1)cc(NC(c2ccccc2)=O)c1C(C)=O

InChI

InChI=1S/C19H21NO2/c1-13(21)16-11-10-15(19(2,3)4)12-17(16)20-18(22)14-8-6-5-7-9-14/h5-12H,1-4H3,(H,20,22)

InChI Key

KKFZHSHXFMQMAT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00561865

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

295.38

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.335

Distribution Coefficient, logD

4.283

Water Solubility, LogSw

-4.33

Polar Surface Area

36.459

Acid Dissociation Constant (pKa)

8.29

Base Dissociation Constant (pKb)

-2.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.32

References: we are preparing a list of scientific research reports with 1658-0064 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1658-0064?
Check Price and Availability of 1658-0064, 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 1658-0064 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1658-0064
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1658-0064
  • 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 1658-0064 available by request