F107-1981 Screening compound: 3-[1,3-bis(2H-1,3-benzodioxol-5-yl)propan-2-yl]-1-(2,4-dimethoxyphenyl)urea

F107-1981 Screening compound: 3-[1,3-bis(2H-1,3-benzodioxol-5-yl)propan-2-yl]-1-(2,4-dimethoxyphenyl)urea
F107-1981 Screening compound: 3-[1,3-bis(2H-1,3-benzodioxol-5-yl)propan-2-yl]-1-(2,4-dimethoxyphenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound F107-1981
3-[1,3-bis(2H-1,3-benzodioxol-5-yl)propan-2-yl]-1-(2,4-dimethoxyphenyl)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

F107-1981

Molecular Formula

C26H26N2O7 (C26 H26 N2 O7)

Compound Name

3-[1,3-bis(2H-1,3-benzodioxol-5-yl)propan-2-yl]-1-(2,4-dimethoxyphenyl)urea

IUPAC name

3-[13-bis(2H-13-benzodioxol-5-yl)propan-2-yl]-1-(24-dimethoxyphenyl)urea

SMILES

COc(cc1)cc(OC)c1NC(NC(Cc(cc1)cc2c1OCO2)Cc(cc1)cc2c1OCO2)=O

InChI

InChI=1S/C26H26N2O7/c1-30-19-5-6-20(23(13-19)31-2)28-26(29)27-18(9-16-3-7-21-24(11-16)34-14-32-21)10-17-4-8-22-25(12-17)35-15-33-22/h3-8,11-13,18H,9-10,14-15H2,1-2H3,(H2,27,28,29)

InChI Key

RZOVNYVDJSFNPX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14941356

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

478.5

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.864

Distribution Coefficient, logD

4.864

Water Solubility, LogSw

-4.68

Polar Surface Area

82.208

Acid Dissociation Constant (pKa)

11.57

Base Dissociation Constant (pKb)

1.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.90

References: we are preparing a list of scientific research reports with F107-1981 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F107-1981?
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What is the minimum amount of F107-1981 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F107-1981
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F107-1981
  • 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 F107-1981 available by request