F235-0768 Screening compound: N-(2-benzyl-1,3-benzoxazol-5-yl)-3-methyl-4-nitrobenzamide

F235-0768 Screening compound: N-(2-benzyl-1,3-benzoxazol-5-yl)-3-methyl-4-nitrobenzamide
F235-0768 Screening compound: N-(2-benzyl-1,3-benzoxazol-5-yl)-3-methyl-4-nitrobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F235-0768
N-(2-benzyl-1,3-benzoxazol-5-yl)-3-methyl-4-nitrobenzamide

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

F235-0768

Molecular Formula

C22H17N3O4 (C22 H17 N3 O4)

Compound Name

N-(2-benzyl-1,3-benzoxazol-5-yl)-3-methyl-4-nitrobenzamide

IUPAC name

N-(2-benzyl-13-benzoxazol-5-yl)-3-methyl-4-nitrobenzamide

SMILES

Cc(cc(cc1)C(Nc(cc2)cc3c2oc(Cc2ccccc2)n3)=O)c1[N+]([O-])=O

InChI

InChI=1S/C22H17N3O4/c1-14-11-16(7-9-19(14)25(27)28)22(26)23-17-8-10-20-18(13-17)24-21(29-20)12-15-5-3-2-4-6-15/h2-11,13H,12H2,1H3,(H,23,26)

InChI Key

REVHPYZLVFSXJI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00613164

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.39

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.174

Distribution Coefficient, logD

5.169

Water Solubility, LogSw

-5.06

Polar Surface Area

72.886

Acid Dissociation Constant (pKa)

9.33

Base Dissociation Constant (pKb)

-2.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

References: we are preparing a list of scientific research reports with F235-0768 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F235-0768?
Check Price and Availability of F235-0768, 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 F235-0768 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F235-0768
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F235-0768
  • 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 F235-0768 available by request