7916-0452 Screening compound: N-[5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-2,4-dimethoxybenzamide

7916-0452 Screening compound: N-[5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-2,4-dimethoxybenzamide
7916-0452 Screening compound: N-[5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-2,4-dimethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 7916-0452
N-[5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-2,4-dimethoxybenzamide

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

7916-0452

Molecular Formula

C25H24N2O4 (C25 H24 N2 O4)

Compound Name

N-[5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-2,4-dimethoxybenzamide

IUPAC name

N-[5-(5-ethyl-13-benzoxazol-2-yl)-2-methylphenyl]-24-dimethoxybenzamide

SMILES

CCc(cc1)cc2c1oc(-c1cc(NC(c(ccc(OC)c3)c3OC)=O)c(C)cc1)n2

InChI

InChI=1S/C25H24N2O4/c1-5-16-7-11-22-21(12-16)27-25(31-22)17-8-6-15(2)20(13-17)26-24(28)19-10-9-18(29-3)14-23(19)30-4/h6-14H,5H2,1-4H3,(H,26,28)

InChI Key

DZPRDHMTVLOYGF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07435932

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.428

Distribution Coefficient, logD

5.428

Water Solubility, LogSw

-5.43

Polar Surface Area

54.616

Acid Dissociation Constant (pKa)

10.65

Base Dissociation Constant (pKb)

-0.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with 7916-0452 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7916-0452?
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What is the minimum amount of 7916-0452 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7916-0452
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7916-0452
  • 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 7916-0452 available by request