4202-1519 Screening compound: 5-[4-(benzyloxy)phenyl]-9-bromo-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine

4202-1519 Screening compound: 5-[4-(benzyloxy)phenyl]-9-bromo-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
4202-1519 Screening compound: 5-[4-(benzyloxy)phenyl]-9-bromo-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 4202-1519
5-[4-(benzyloxy)phenyl]-9-bromo-2-phenyl-1,10b-dihydropyrazolo[1,5-c][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

4202-1519

Molecular Formula

C29H23BrN2O2 (C29 H23 BrN2 O2)

Compound Name

5-[4-(benzyloxy)phenyl]-9-bromo-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine

IUPAC name

7-[4-(benzyloxy)phenyl]-12-bromo-4-phenyl-8-oxa-56-diazatricyclo[7.4.0.0^{26}]trideca-1(9)41012-tetraene

SMILES

Brc(cc1)cc(C2C3)c1OC(c(cc1)ccc1OCc1ccccc1)N2N=C3c1ccccc1

InChI

InChI=1S/C29H23BrN2O2/c30-23-13-16-28-25(17-23)27-18-26(21-9-5-2-6-10-21)31-32(27)29(34-28)22-11-14-24(15-12-22)33-19-20-7-3-1-4-8-20/h1-17,27,29H,18-19H2

InChI Key

KEGGKGYABLDMHD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02991113

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

511.42

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

7.371

Distribution Coefficient, logD

7.371

Water Solubility, LogSw

-6.34

Polar Surface Area

29.273

Acid Dissociation Constant (pKa)

16.85

Base Dissociation Constant (pKb)

2.59

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

13.80

References: we are preparing a list of scientific research reports with 4202-1519 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4202-1519?
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What is the minimum amount of 4202-1519 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4202-1519
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4202-1519
  • 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 4202-1519 available by request