D101-0029 Screening compound: N-cyclohexyl-N-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-4-methylbenzene-1-sulfonamide

D101-0029 Screening compound: N-cyclohexyl-N-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-4-methylbenzene-1-sulfonamide
D101-0029 Screening compound: N-cyclohexyl-N-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-4-methylbenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D101-0029
N-cyclohexyl-N-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-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

D101-0029

Molecular Formula

C23H27N3O4S (C23 H27 N3 O4 S)

Compound Name

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

IUPAC name

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

SMILES

Cc(cc1)ccc1S(N(Cc1nc(-c(cc2)ccc2OC)no1)C1CCCCC1)(=O)=O

InChI

InChI=1S/C23H27N3O4S/c1-17-8-14-21(15-9-17)31(27,28)26(19-6-4-3-5-7-19)16-22-24-23(25-30-22)18-10-12-20(29-2)13-11-18/h8-15,19H,3-7,16H2,1-2H3

InChI Key

MKOCECIPKACUOF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07629145

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

441.55

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

5.704

Distribution Coefficient, logD

5.704

Water Solubility, LogSw

-5.42

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

39.10

D101-0029 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with D101-0029 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D101-0029?
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What is the minimum amount of D101-0029 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D101-0029
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D101-0029
  • 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 D101-0029 available by request