F107-1191 Screening compound: 1-[1-(2H-1,3-benzodioxol-5-yl)-3-(4-fluorophenyl)propan-2-yl]-3-(3,5-dimethoxyphenyl)urea

F107-1191 Screening compound: 1-[1-(2H-1,3-benzodioxol-5-yl)-3-(4-fluorophenyl)propan-2-yl]-3-(3,5-dimethoxyphenyl)urea
F107-1191 Screening compound: 1-[1-(2H-1,3-benzodioxol-5-yl)-3-(4-fluorophenyl)propan-2-yl]-3-(3,5-dimethoxyphenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound F107-1191
1-[1-(2H-1,3-benzodioxol-5-yl)-3-(4-fluorophenyl)propan-2-yl]-3-(3,5-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

F107-1191

Molecular Formula

C25H25FN2O5 (C25 H25 FN2 O5)

Compound Name

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

IUPAC name

1-[1-(2H-13-benzodioxol-5-yl)-3-(4-fluorophenyl)propan-2-yl]-3-(35-dimethoxyphenyl)urea

SMILES

COc1cc(NC(NC(Cc(cc2)ccc2F)Cc(cc2)cc3c2OCO3)=O)cc(OC)c1

InChI

InChI=1S/C25H25FN2O5/c1-30-21-12-20(13-22(14-21)31-2)28-25(29)27-19(9-16-3-6-18(26)7-4-16)10-17-5-8-23-24(11-17)33-15-32-23/h3-8,11-14,19H,9-10,15H2,1-2H3,(H2,27,28,29)/t19-/m0/s1

InChI Key

QNELORJMMPBLMH-IBGZPJMESA-N

MDL Number (MFCD)

MFCD14941278

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.401

Distribution Coefficient, logD

5.400

Water Solubility, LogSw

-5.47

Polar Surface Area

65.704

Acid Dissociation Constant (pKa)

11.38

Base Dissociation Constant (pKb)

0.25

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

24.00

F107-1191 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with F107-1191 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F107-1191?
Check Price and Availability of F107-1191, 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 F107-1191 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F107-1191
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F107-1191
  • 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 F107-1191 available by request