C636-2408 Screening compound: methyl 4-{2-[3-cyclohexyl-1-(4-methylphenyl)-2,5-dioxoimidazolidin-4-yl]acetamido}benzoate

C636-2408 Screening compound: methyl 4-{2-[3-cyclohexyl-1-(4-methylphenyl)-2,5-dioxoimidazolidin-4-yl]acetamido}benzoate
C636-2408 Screening compound: methyl 4-{2-[3-cyclohexyl-1-(4-methylphenyl)-2,5-dioxoimidazolidin-4-yl]acetamido}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound C636-2408
methyl 4-{2-[3-cyclohexyl-1-(4-methylphenyl)-2,5-dioxoimidazolidin-4-yl]acetamido}benzoate

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

C636-2408

Molecular Formula

C26H29N3O5 (C26 H29 N3 O5)

Compound Name

methyl 4-{2-[3-cyclohexyl-1-(4-methylphenyl)-2,5-dioxoimidazolidin-4-yl]acetamido}benzoate

IUPAC name

methyl 4-{2-[3-cyclohexyl-1-(4-methylphenyl)-25-dioxoimidazolidin-4-yl]acetamido}benzoate

SMILES

Cc(cc1)ccc1N(C(C(CC(Nc(cc1)ccc1C(OC)=O)=O)N1C2CCCCC2)=O)C1=O

InChI

InChI=1S/C26H29N3O5/c1-17-8-14-21(15-9-17)29-24(31)22(28(26(29)33)20-6-4-3-5-7-20)16-23(30)27-19-12-10-18(11-13-19)25(32)34-2/h8-15,20,22H,3-7,16H2,1-2H3,(H,27,30)/t22-/m1/s1

InChI Key

OCMKXGUHAHACGZ-JOCHJYFZSA-N

MDL Number (MFCD)

MFCD06663698

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

463.53

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.184

Distribution Coefficient, logD

4.183

Water Solubility, LogSw

-4.19

Polar Surface Area

75.100

Acid Dissociation Constant (pKa)

10.49

Base Dissociation Constant (pKb)

-1.04

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.50

C636-2408 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 C636-2408 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C636-2408?
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What is the minimum amount of C636-2408 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C636-2408
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C636-2408
  • 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 C636-2408 available by request