C151-0877 Screening compound: 2-[(E)-1-(4-isopropoxy-3-methoxyphenyl)methylidene]-5-[(Z)-2-methylpropylidene]-1-cyclopentanone

C151-0877 Screening compound: 2-[(E)-1-(4-isopropoxy-3-methoxyphenyl)methylidene]-5-[(Z)-2-methylpropylidene]-1-cyclopentanone
C151-0877 Screening compound: 2-[(E)-1-(4-isopropoxy-3-methoxyphenyl)methylidene]-5-[(Z)-2-methylpropylidene]-1-cyclopentanone alternative view

Chemical Structure Depiction of ChemDiv screening compound C151-0877
2-[(E)-1-(4-isopropoxy-3-methoxyphenyl)methylidene]-5-[(Z)-2-methylpropylidene]-1-cyclopentanone

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

C151-0877

Molecular Formula

C20H26O3 (C20 H26 O3)

Compound Name

2-[(E)-1-(4-isopropoxy-3-methoxyphenyl)methylidene]-5-[(Z)-2-methylpropylidene]-1-cyclopentanone

IUPAC name

(2E5Z)-2-{[3-methoxy-4-(propan-2-yloxy)phenyl]methylidene}-5-(2-methylpropylidene)cyclopentan-1-one

SMILES

CC(C)/C=C(/CC/C1=C\c(cc2)cc(OC)c2OC(C)C)\C1=O

InChI

InChI=1S/C20H26O3/c1-13(2)10-16-7-8-17(20(16)21)11-15-6-9-18(23-14(3)4)19(12-15)22-5/h6,9-14H,7-8H2,1-5H3

InChI Key

UFEDQQLQZCHPNA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14723051

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

314.42

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.627

Distribution Coefficient, logD

4.627

Water Solubility, LogSw

-4.45

Polar Surface Area

28.191

Acid Dissociation Constant (pKa)

28.56

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.00

C151-0877 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with C151-0877 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C151-0877?
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What is the minimum amount of C151-0877 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C151-0877
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C151-0877
  • 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 C151-0877 available by request