4202-1517 Screening compound: 4-(9-bromo-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl)-2-methoxyphenyl methyl ether

4202-1517 Screening compound: 4-(9-bromo-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl)-2-methoxyphenyl methyl ether
4202-1517 Screening compound: 4-(9-bromo-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl)-2-methoxyphenyl methyl ether alternative view

Chemical Structure Depiction of ChemDiv screening compound 4202-1517
4-(9-bromo-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl)-2-methoxyphenyl methyl ether

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

4202-1517

Molecular Formula

C24H21BrN2O3 (C24 H21 BrN2 O3)

Compound Name

4-(9-bromo-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl)-2-methoxyphenyl methyl ether

IUPAC name

12-bromo-7-(34-dimethoxyphenyl)-4-phenyl-8-oxa-56-diazatricyclo[7.4.0.0^{26}]trideca-1(9)41012-tetraene

SMILES

COc(ccc(C(N(C1C2)N=C2c2ccccc2)Oc(cc2)c1cc2Br)c1)c1OC

InChI

InChI=1S/C24H21BrN2O3/c1-28-22-10-8-16(12-23(22)29-2)24-27-20(18-13-17(25)9-11-21(18)30-24)14-19(26-27)15-6-4-3-5-7-15/h3-13,20,24H,14H2,1-2H3

InChI Key

RXONEUKDSPVMHK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01416475

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

465.35

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.589

Distribution Coefficient, logD

5.589

Water Solubility, LogSw

-5.67

Polar Surface Area

37.307

Acid Dissociation Constant (pKa)

16.85

Base Dissociation Constant (pKb)

2.46

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

20.80

References: we are preparing a list of scientific research reports with 4202-1517 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4202-1517?
Check Price and Availability of 4202-1517, 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 4202-1517 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4202-1517
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4202-1517
  • 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 4202-1517 available by request