2783-5047 Screening compound: 4-chloro-N-[5-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-3-nitrobenzamide

2783-5047 Screening compound: 4-chloro-N-[5-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-3-nitrobenzamide
2783-5047 Screening compound: 4-chloro-N-[5-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-3-nitrobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2783-5047
4-chloro-N-[5-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-3-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

2783-5047

Molecular Formula

C23H18ClN3O4 (C23 H18 ClN3 O4)

Compound Name

4-chloro-N-[5-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-3-nitrobenzamide

IUPAC name

4-chloro-N-[5-(57-dimethyl-13-benzoxazol-2-yl)-2-methylphenyl]-3-nitrobenzamide

SMILES

Cc(cc1C)cc2c1oc(-c1cc(NC(c(cc3)cc([N+]([O-])=O)c3Cl)=O)c(C)cc1)n2

InChI

InChI=1S/C23H18ClN3O4/c1-12-8-14(3)21-19(9-12)26-23(31-21)16-5-4-13(2)18(10-16)25-22(28)15-6-7-17(24)20(11-15)27(29)30/h4-11H,1-3H3,(H,25,28)

InChI Key

NREWELHETAUNJU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01145821

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.87

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.682

Distribution Coefficient, logD

5.678

Water Solubility, LogSw

-6.04

Polar Surface Area

72.756

Acid Dissociation Constant (pKa)

9.55

Base Dissociation Constant (pKb)

-0.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

References: we are preparing a list of scientific research reports with 2783-5047 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2783-5047?
Check Price and Availability of 2783-5047, 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 2783-5047 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2783-5047
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2783-5047
  • 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 2783-5047 available by request