7294-0780 Screening compound: 1-[2-(4-tert-butylphenyl)-4-(4-methylbenzenesulfonyl)-1,3-oxazol-5-yl]-4-methylpiperidine

7294-0780 Screening compound: 1-[2-(4-tert-butylphenyl)-4-(4-methylbenzenesulfonyl)-1,3-oxazol-5-yl]-4-methylpiperidine
7294-0780 Screening compound: 1-[2-(4-tert-butylphenyl)-4-(4-methylbenzenesulfonyl)-1,3-oxazol-5-yl]-4-methylpiperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound 7294-0780
1-[2-(4-tert-butylphenyl)-4-(4-methylbenzenesulfonyl)-1,3-oxazol-5-yl]-4-methylpiperidine

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

7294-0780

Molecular Formula

C26H32N2O3S (C26 H32 N2 O3 S)

Compound Name

1-[2-(4-tert-butylphenyl)-4-(4-methylbenzenesulfonyl)-1,3-oxazol-5-yl]-4-methylpiperidine

IUPAC name

1-[2-(4-tert-butylphenyl)-4-(4-methylbenzenesulfonyl)-13-oxazol-5-yl]-4-methylpiperidine

SMILES

CC(CC1)CCN1c(oc(-c1ccc(C(C)(C)C)cc1)n1)c1S(c1ccc(C)cc1)(=O)=O

InChI

InChI=1S/C26H32N2O3S/c1-18-6-12-22(13-7-18)32(29,30)24-25(28-16-14-19(2)15-17-28)31-23(27-24)20-8-10-21(11-9-20)26(3,4)5/h6-13,19H,14-17H2,1-5H3

InChI Key

OFLMGIPDLBIKOM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07497996

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.62

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

7.178

Distribution Coefficient, logD

7.178

Water Solubility, LogSw

-5.83

Polar Surface Area

51.479

Acid Dissociation Constant (pKa)

25.92

Base Dissociation Constant (pKb)

-5.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.30

7294-0780 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 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 7294-0780 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7294-0780?
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What is the minimum amount of 7294-0780 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7294-0780
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7294-0780
  • 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 7294-0780 available by request