3448-1937 Screening compound: 3-[5-fluoro-4-oxo-5-(trifluoromethyl)-4,5-dihydro-1,3-thiazol-2-yl]-1-[3-(trifluoromethyl)phenyl]urea

3448-1937 Screening compound: 3-[5-fluoro-4-oxo-5-(trifluoromethyl)-4,5-dihydro-1,3-thiazol-2-yl]-1-[3-(trifluoromethyl)phenyl]urea
3448-1937 Screening compound: 3-[5-fluoro-4-oxo-5-(trifluoromethyl)-4,5-dihydro-1,3-thiazol-2-yl]-1-[3-(trifluoromethyl)phenyl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound 3448-1937
3-[5-fluoro-4-oxo-5-(trifluoromethyl)-4,5-dihydro-1,3-thiazol-2-yl]-1-[3-(trifluoromethyl)phenyl]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

3448-1937

Molecular Formula

C12H6F7N3O2S (C12 H6 F7 N3 O2 S)

Compound Name

3-[5-fluoro-4-oxo-5-(trifluoromethyl)-4,5-dihydro-1,3-thiazol-2-yl]-1-[3-(trifluoromethyl)phenyl]urea

IUPAC name

3-[5-fluoro-4-oxo-5-(trifluoromethyl)-45-dihydro-13-thiazol-2-yl]-1-[3-(trifluoromethyl)phenyl]urea

SMILES

O=C(NC(SC1(C(F)(F)F)F)=NC1=O)Nc1cc(C(F)(F)F)ccc1

InChI

InChI=1S/C12H6F7N3O2S/c13-10(12(17,18)19)7(23)21-9(25-10)22-8(24)20-6-3-1-2-5(4-6)11(14,15)16/h1-4H,(H2,20,21,22,23,24)/t10-/m1/s1

InChI Key

ZJEUMCUVWHWNLF-SNVBAGLBSA-N

MDL Number (MFCD)

MFCD01561016

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.25

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.014

Distribution Coefficient, logD

4.007

Water Solubility, LogSw

-4.29

Polar Surface Area

55.286

Acid Dissociation Constant (pKa)

9.15

Base Dissociation Constant (pKb)

-2.80

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with 3448-1937 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3448-1937?
Check Price and Availability of 3448-1937, 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 3448-1937 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3448-1937
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3448-1937
  • 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 3448-1937 available by request