D047-0168 Screening compound: 3-[2-(5-METHOXY-1H-INDOL-3-YL)ETHYL]-1-[4-(TRIFLUOROMETHYL)PHENYL]UREA

D047-0168 Screening compound: 3-[2-(5-METHOXY-1H-INDOL-3-YL)ETHYL]-1-[4-(TRIFLUOROMETHYL)PHENYL]UREA
D047-0168 Screening compound: 3-[2-(5-METHOXY-1H-INDOL-3-YL)ETHYL]-1-[4-(TRIFLUOROMETHYL)PHENYL]UREA alternative view

Chemical Structure Depiction of ChemDiv screening compound D047-0168
3-[2-(5-METHOXY-1H-INDOL-3-YL)ETHYL]-1-[4-(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

D047-0168

Molecular Formula

C19H18F3N3O2 (C19 H18 F3 N3 O2)

Compound Name

3-[2-(5-METHOXY-1H-INDOL-3-YL)ETHYL]-1-[4-(TRIFLUOROMETHYL)PHENYL]UREA

IUPAC name

n/a

SMILES

COc(cc1)cc2c1[nH]cc2CCNC(Nc1ccc(C(F)(F)F)cc1)=O

InChI

InChI=1S/C19H18F3N3O2/c1-27-15-6-7-17-16(10-15)12(11-24-17)8-9-23-18(26)25-14-4-2-13(3-5-14)19(20,21)22/h2-7,10-11,24H,8-9H2,1H3,(H2,23,25,26)

InChI Key

YGLILLIKNGJLDT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01260798

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.37

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.306

Distribution Coefficient, logD

4.306

Water Solubility, LogSw

-4.35

Polar Surface Area

51.120

Acid Dissociation Constant (pKa)

13.23

Base Dissociation Constant (pKb)

-0.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.00

References: we are preparing a list of scientific research reports with D047-0168 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D047-0168?
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What is the minimum amount of D047-0168 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D047-0168
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D047-0168
  • 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 D047-0168 available by request