D101-0033 Screening compound: 4-chloro-N-cyclohexyl-N-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}benzene-1-sulfonamide

D101-0033 Screening compound: 4-chloro-N-cyclohexyl-N-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}benzene-1-sulfonamide
D101-0033 Screening compound: 4-chloro-N-cyclohexyl-N-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D101-0033
4-chloro-N-cyclohexyl-N-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}benzene-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

D101-0033

Molecular Formula

C22H24ClN3O4S (C22 H24 ClN3 O4 S)

Compound Name

4-chloro-N-cyclohexyl-N-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}benzene-1-sulfonamide

IUPAC name

4-chloro-N-cyclohexyl-N-{[3-(4-methoxyphenyl)-124-oxadiazol-5-yl]methyl}benzene-1-sulfonamide

SMILES

COc(cc1)ccc1-c1noc(CN(C2CCCCC2)S(c(cc2)ccc2Cl)(=O)=O)n1

InChI

InChI=1S/C22H24ClN3O4S/c1-29-19-11-7-16(8-12-19)22-24-21(30-25-22)15-26(18-5-3-2-4-6-18)31(27,28)20-13-9-17(23)10-14-20/h7-14,18H,2-6,15H2,1H3

InChI Key

UAAGEYWPHHCAMZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07629132

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

461.97

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.876

Distribution Coefficient, logD

5.876

Water Solubility, LogSw

-6.20

Polar Surface Area

70.512

Acid Dissociation Constant (pKa)

25.98

Base Dissociation Constant (pKb)

-3.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

References: we are preparing a list of scientific research reports with D101-0033 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D101-0033?
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What is the minimum amount of D101-0033 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D101-0033
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D101-0033
  • 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 D101-0033 available by request