4928-0026 Screening compound: 1-[2,4-bis(2-methylbutan-2-yl)phenoxy]-3-[4-(4-methylphenyl)piperazin-1-yl]propan-2-ol

4928-0026 Screening compound: 1-[2,4-bis(2-methylbutan-2-yl)phenoxy]-3-[4-(4-methylphenyl)piperazin-1-yl]propan-2-ol
4928-0026 Screening compound: 1-[2,4-bis(2-methylbutan-2-yl)phenoxy]-3-[4-(4-methylphenyl)piperazin-1-yl]propan-2-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 4928-0026
1-[2,4-bis(2-methylbutan-2-yl)phenoxy]-3-[4-(4-methylphenyl)piperazin-1-yl]propan-2-ol

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

4928-0026

Molecular Formula

C30H46N2O2 (C30 H46 N2 O2)

Compound Name

1-[2,4-bis(2-methylbutan-2-yl)phenoxy]-3-[4-(4-methylphenyl)piperazin-1-yl]propan-2-ol

IUPAC name

1-[24-bis(2-methylbutan-2-yl)phenoxy]-3-[4-(4-methylphenyl)piperazin-1-yl]propan-2-ol

SMILES

CCC(C)(C)c(cc1)cc(C(C)(C)CC)c1OCC(CN(CC1)CCN1c1ccc(C)cc1)O

InChI

InChI=1S/C30H46N2O2/c1-8-29(4,5)24-12-15-28(27(20-24)30(6,7)9-2)34-22-26(33)21-31-16-18-32(19-17-31)25-13-10-23(3)11-14-25/h10-15,20,26,33H,8-9,16-19,21-22H2,1-7H3/t26-/m0/s1

InChI Key

KSSJRIHBMASSDK-SANMLTNESA-N

MDL Number (MFCD)

MFCD03448159

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.71

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

7.733

Distribution Coefficient, logD

7.675

Water Solubility, LogSw

-5.80

Polar Surface Area

31.437

Acid Dissociation Constant (pKa)

16.26

Base Dissociation Constant (pKb)

6.56

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

60.00

4928-0026 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 4928-0026 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4928-0026?
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What is the minimum amount of 4928-0026 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4928-0026
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4928-0026
  • 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 4928-0026 available by request