5705-0505 Screening compound: N-[(1E)-1-[3-(benzenesulfonyl)-2-(4-methoxyphenyl)imidazolidin-1-yl]-2-(piperidin-1-yl)ethylidene]-4-methylbenzene-1-sulfonamide

5705-0505 Screening compound: N-[(1E)-1-[3-(benzenesulfonyl)-2-(4-methoxyphenyl)imidazolidin-1-yl]-2-(piperidin-1-yl)ethylidene]-4-methylbenzene-1-sulfonamide
5705-0505 Screening compound: N-[(1E)-1-[3-(benzenesulfonyl)-2-(4-methoxyphenyl)imidazolidin-1-yl]-2-(piperidin-1-yl)ethylidene]-4-methylbenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5705-0505
N-[(1E)-1-[3-(benzenesulfonyl)-2-(4-methoxyphenyl)imidazolidin-1-yl]-2-(piperidin-1-yl)ethylidene]-4-methylbenzene-1-sulfonamide

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

5705-0505

Molecular Formula

C30H36N4O5S2 (C30 H36 N4 O5 S2)

Compound Name

N-[(1E)-1-[3-(benzenesulfonyl)-2-(4-methoxyphenyl)imidazolidin-1-yl]-2-(piperidin-1-yl)ethylidene]-4-methylbenzene-1-sulfonamide

IUPAC name

N-[(1E)-1-[3-(benzenesulfonyl)-2-(4-methoxyphenyl)imidazolidin-1-yl]-2-(piperidin-1-yl)ethylidene]-4-methylbenzene-1-sulfonamide

SMILES

Cc(cc1)ccc1S(/N=C(\CN1CCCCC1)/N(CC1)C(c(cc2)ccc2OC)N1S(c1ccccc1)(=O)=O)(=O)=O

InChI

InChI=1S/C30H36N4O5S2/c1-24-11-17-27(18-12-24)40(35,36)31-29(23-32-19-7-4-8-20-32)33-21-22-34(41(37,38)28-9-5-3-6-10-28)30(33)25-13-15-26(39-2)16-14-25/h3,5-6,9-18,30H,4,7-8,19-23H2,1-2H3/t30-/m0/s1

InChI Key

YWQVRYWVRCJTJX-PMERELPUSA-N

MDL Number (MFCD)

MFCD03828049

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

596.77

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.731

Distribution Coefficient, logD

4.622

Water Solubility, LogSw

-4.36

Polar Surface Area

85.818

Acid Dissociation Constant (pKa)

23.73

Base Dissociation Constant (pKb)

6.85

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.70

References: we are preparing a list of scientific research reports with 5705-0505 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5705-0505?
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What is the minimum amount of 5705-0505 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5705-0505
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5705-0505
  • 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 5705-0505 available by request