C202-2245 Screening compound: 9-[(2H-1,3-benzodioxol-5-yl)methyl]-4-phenyl-2H,8H,9H,10H-chromeno[8,7-e][1,3]oxazin-2-one

C202-2245 Screening compound: 9-[(2H-1,3-benzodioxol-5-yl)methyl]-4-phenyl-2H,8H,9H,10H-chromeno[8,7-e][1,3]oxazin-2-one
C202-2245 Screening compound: 9-[(2H-1,3-benzodioxol-5-yl)methyl]-4-phenyl-2H,8H,9H,10H-chromeno[8,7-e][1,3]oxazin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C202-2245
9-[(2H-1,3-benzodioxol-5-yl)methyl]-4-phenyl-2H,8H,9H,10H-chromeno[8,7-e][1,3]oxazin-2-one

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

C202-2245

Molecular Formula

C25H19NO5 (C25 H19 NO5)

Compound Name

9-[(2H-1,3-benzodioxol-5-yl)methyl]-4-phenyl-2H,8H,9H,10H-chromeno[8,7-e][1,3]oxazin-2-one

IUPAC name

9-[(2H-13-benzodioxol-5-yl)methyl]-4-phenyl-2H8H9H10H-chromeno[87-e][13]oxazin-2-one

SMILES

O=C1Oc(c2c(cc3)OCN(Cc(cc4)cc5c4OCO5)C2)c3C(c2ccccc2)=C1

InChI

InChI=1S/C25H19NO5/c27-24-11-19(17-4-2-1-3-5-17)18-7-9-21-20(25(18)31-24)13-26(14-28-21)12-16-6-8-22-23(10-16)30-15-29-22/h1-11H,12-15H2

InChI Key

CXXAQKJAKQDSBM-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.338

Distribution Coefficient, logD

4.060

Water Solubility, LogSw

-4.52

Polar Surface Area

49.758

Acid Dissociation Constant (pKa)

26.74

Base Dissociation Constant (pKb)

7.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.00

References: we are preparing a list of scientific research reports with C202-2245 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C202-2245?
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What is the minimum amount of C202-2245 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C202-2245
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C202-2245
  • 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 C202-2245 available by request