S400-0033 Screening compound: (4-METHOXYPHENYL)[(1E)-1-[(4-METHOXYPHENYL)METHYLIDENE]-1H-INDEN-3-YL]METHANOL

S400-0033 Screening compound: (4-METHOXYPHENYL)[(1E)-1-[(4-METHOXYPHENYL)METHYLIDENE]-1H-INDEN-3-YL]METHANOL
S400-0033 Screening compound: (4-METHOXYPHENYL)[(1E)-1-[(4-METHOXYPHENYL)METHYLIDENE]-1H-INDEN-3-YL]METHANOL alternative view

Chemical Structure Depiction of ChemDiv screening compound S400-0033
(4-METHOXYPHENYL)[(1E)-1-[(4-METHOXYPHENYL)METHYLIDENE]-1H-INDEN-3-YL]METHANOL

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

S400-0033

Molecular Formula

C25H22O3 (C25 H22 O3)

Compound Name

(4-METHOXYPHENYL)[(1E)-1-[(4-METHOXYPHENYL)METHYLIDENE]-1H-INDEN-3-YL]METHANOL

IUPAC name

n/a

SMILES

COc1ccc(C(C(c2c3cccc2)=C/C3=C\c(cc2)ccc2OC)O)cc1

InChI

InChI=1S/C25H22O3/c1-27-20-11-7-17(8-12-20)15-19-16-24(23-6-4-3-5-22(19)23)25(26)18-9-13-21(28-2)14-10-18/h3-16,25-26H,1-2H3/t25-/m1/s1

InChI Key

JZUFNWAOJOOJPR-RUZDIDTESA-N

MDL Number (MFCD)

MFCD28993008

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.45

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.235

Distribution Coefficient, logD

5.235

Water Solubility, LogSw

-5.07

Polar Surface Area

30.754

Acid Dissociation Constant (pKa)

14.30

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

12.00

S400-0033 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with S400-0033 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S400-0033?
Check Price and Availability of S400-0033, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of S400-0033 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S400-0033
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S400-0033
  • 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 S400-0033 available by request