8222-0038 Screening compound: N-[5-oxo-2-phenyl-1-propyl-4-(trifluoromethyl)-4,5-dihydro-1H-imidazol-4-yl]furan-2-carboxamide

8222-0038 Screening compound: N-[5-oxo-2-phenyl-1-propyl-4-(trifluoromethyl)-4,5-dihydro-1H-imidazol-4-yl]furan-2-carboxamide
8222-0038 Screening compound: N-[5-oxo-2-phenyl-1-propyl-4-(trifluoromethyl)-4,5-dihydro-1H-imidazol-4-yl]furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8222-0038
N-[5-oxo-2-phenyl-1-propyl-4-(trifluoromethyl)-4,5-dihydro-1H-imidazol-4-yl]furan-2-carboxamide

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

8222-0038

Molecular Formula

C18H16F3N3O3 (C18 H16 F3 N3 O3)

Compound Name

N-[5-oxo-2-phenyl-1-propyl-4-(trifluoromethyl)-4,5-dihydro-1H-imidazol-4-yl]furan-2-carboxamide

IUPAC name

N-[5-oxo-2-phenyl-1-propyl-4-(trifluoromethyl)-45-dihydro-1H-imidazol-4-yl]furan-2-carboxamide

SMILES

CCCN(C1=O)C(c2ccccc2)=NC1(C(F)(F)F)NC(c1ccco1)=O

InChI

InChI=1S/C18H16F3N3O3/c1-2-10-24-14(12-7-4-3-5-8-12)22-17(16(24)26,18(19,20)21)23-15(25)13-9-6-11-27-13/h3-9,11H,2,10H2,1H3,(H,23,25)/t17-/m0/s1

InChI Key

RFLSOWDFLDASGE-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD08065439

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

379.34

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.266

Distribution Coefficient, logD

0.503

Water Solubility, LogSw

-3.37

Polar Surface Area

59.495

Acid Dissociation Constant (pKa)

4.64

Base Dissociation Constant (pKb)

-0.25

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.80

8222-0038 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8222-0038 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8222-0038?
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What is the minimum amount of 8222-0038 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8222-0038
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8222-0038
  • 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 8222-0038 available by request