F107-1969 Screening compound: 3-[1,3-bis(2H-1,3-benzodioxol-5-yl)propan-2-yl]-1-(3-methylphenyl)urea

F107-1969 Screening compound: 3-[1,3-bis(2H-1,3-benzodioxol-5-yl)propan-2-yl]-1-(3-methylphenyl)urea
F107-1969 Screening compound: 3-[1,3-bis(2H-1,3-benzodioxol-5-yl)propan-2-yl]-1-(3-methylphenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound F107-1969
3-[1,3-bis(2H-1,3-benzodioxol-5-yl)propan-2-yl]-1-(3-methylphenyl)urea

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

F107-1969

Molecular Formula

C25H24N2O5 (C25 H24 N2 O5)

Compound Name

3-[1,3-bis(2H-1,3-benzodioxol-5-yl)propan-2-yl]-1-(3-methylphenyl)urea

IUPAC name

3-[13-bis(2H-13-benzodioxol-5-yl)propan-2-yl]-1-(3-methylphenyl)urea

SMILES

Cc1cccc(NC(NC(Cc(cc2)cc3c2OCO3)Cc(cc2)cc3c2OCO3)=O)c1

InChI

InChI=1S/C25H24N2O5/c1-16-3-2-4-19(9-16)26-25(28)27-20(10-17-5-7-21-23(12-17)31-14-29-21)11-18-6-8-22-24(13-18)32-15-30-22/h2-9,12-13,20H,10-11,14-15H2,1H3,(H2,26,27,28)

InChI Key

LZZDMYAHSOWLLJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14941348

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.478

Distribution Coefficient, logD

5.478

Water Solubility, LogSw

-5.48

Polar Surface Area

67.732

Acid Dissociation Constant (pKa)

13.52

Base Dissociation Constant (pKb)

1.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

F107-1969 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F107-1969 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F107-1969?
Check Price and Availability of F107-1969, 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 F107-1969 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F107-1969
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F107-1969
  • 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 F107-1969 available by request