C636-0806 Screening compound: 2-[1-(4-fluorophenyl)-3-(3-methylbutyl)-2,5-dioxoimidazolidin-4-yl]-N-phenylacetamide

C636-0806 Screening compound: 2-[1-(4-fluorophenyl)-3-(3-methylbutyl)-2,5-dioxoimidazolidin-4-yl]-N-phenylacetamide
C636-0806 Screening compound: 2-[1-(4-fluorophenyl)-3-(3-methylbutyl)-2,5-dioxoimidazolidin-4-yl]-N-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C636-0806
2-[1-(4-fluorophenyl)-3-(3-methylbutyl)-2,5-dioxoimidazolidin-4-yl]-N-phenylacetamide

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

C636-0806

Molecular Formula

C22H24FN3O3 (C22 H24 FN3 O3)

Compound Name

2-[1-(4-fluorophenyl)-3-(3-methylbutyl)-2,5-dioxoimidazolidin-4-yl]-N-phenylacetamide

IUPAC name

2-[1-(4-fluorophenyl)-3-(3-methylbutyl)-25-dioxoimidazolidin-4-yl]-N-phenylacetamide

SMILES

CC(C)CCN(C(CC(Nc1ccccc1)=O)C(N1c(cc2)ccc2F)=O)C1=O

InChI

InChI=1S/C22H24FN3O3/c1-15(2)12-13-25-19(14-20(27)24-17-6-4-3-5-7-17)21(28)26(22(25)29)18-10-8-16(23)9-11-18/h3-11,15,19H,12-14H2,1-2H3,(H,24,27)/t19-/m1/s1

InChI Key

XRWWXLHMIIEQHH-LJQANCHMSA-N

MDL Number (MFCD)

MFCD06165233

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.45

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.466

Distribution Coefficient, logD

3.466

Water Solubility, LogSw

-3.69

Polar Surface Area

54.954

Acid Dissociation Constant (pKa)

12.18

Base Dissociation Constant (pKb)

0.65

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.80

C636-0806 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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 C636-0806 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C636-0806?
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What is the minimum amount of C636-0806 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C636-0806
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C636-0806
  • 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 C636-0806 available by request