5571-0073 Screening compound: 3-(2,4-dimethylphenyl)-6-[(1E)-2-phenyldiazen-1-yl]-3,4-dihydro-2H-1,3-benzoxazine

5571-0073 Screening compound: 3-(2,4-dimethylphenyl)-6-[(1E)-2-phenyldiazen-1-yl]-3,4-dihydro-2H-1,3-benzoxazine
5571-0073 Screening compound: 3-(2,4-dimethylphenyl)-6-[(1E)-2-phenyldiazen-1-yl]-3,4-dihydro-2H-1,3-benzoxazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 5571-0073
3-(2,4-dimethylphenyl)-6-[(1E)-2-phenyldiazen-1-yl]-3,4-dihydro-2H-1,3-benzoxazine

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

5571-0073

Molecular Formula

C22H21N3O (C22 H21 N3 O)

Compound Name

3-(2,4-dimethylphenyl)-6-[(1E)-2-phenyldiazen-1-yl]-3,4-dihydro-2H-1,3-benzoxazine

IUPAC name

3-(24-dimethylphenyl)-6-[(1E)-2-phenyldiazen-1-yl]-34-dihydro-2H-13-benzoxazine

SMILES

Cc(cc1)cc(C)c1N(C1)COc(cc2)c1cc2/N=N/c1ccccc1

InChI

InChI=1S/C22H21N3O/c1-16-8-10-21(17(2)12-16)25-14-18-13-20(9-11-22(18)26-15-25)24-23-19-6-4-3-5-7-19/h3-13H,14-15H2,1-2H3

InChI Key

HHBBXYMIXDZYPW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03673123

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

343.43

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.584

Distribution Coefficient, logD

6.584

Water Solubility, LogSw

-5.82

Polar Surface Area

33.929

Acid Dissociation Constant (pKa)

26.59

Base Dissociation Constant (pKb)

2.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

References: we are preparing a list of scientific research reports with 5571-0073 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5571-0073?
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What is the minimum amount of 5571-0073 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5571-0073
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5571-0073
  • 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 5571-0073 available by request