1165-0397 Screening compound: 3-bromo-4-[(E)butylidene]-2,6-diphenyl-4H-pyran

1165-0397 Screening compound: 3-bromo-4-[(E)butylidene]-2,6-diphenyl-4H-pyran
1165-0397 Screening compound: 3-bromo-4-[(E)butylidene]-2,6-diphenyl-4H-pyran alternative view

Chemical Structure Depiction of ChemDiv screening compound 1165-0397
3-bromo-4-[(E)butylidene]-2,6-diphenyl-4H-pyran

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

1165-0397

Molecular Formula

C21H19BrO (C21 H19 BrO)

Compound Name

3-bromo-4-[(E)butylidene]-2,6-diphenyl-4H-pyran

IUPAC name

n/a

SMILES

CCC/C=C1/C(Br)=C(c2ccccc2)OC(c2ccccc2)=C1

InChI

InChI=1S/C21H19BrO/c1-2-3-10-18-15-19(16-11-6-4-7-12-16)23-21(20(18)22)17-13-8-5-9-14-17/h4-15H,2-3H2,1H3

InChI Key

OUCZSEAEASNQHY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03826460

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.29

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

1

Partition Coefficient, logP

6.995

Distribution Coefficient, logD

6.995

Water Solubility, LogSw

-6.06

Polar Surface Area

8.617

Acid Dissociation Constant (pKa)

27.88

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

1165-0397 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 1165-0397 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1165-0397?
Check Price and Availability of 1165-0397, 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 1165-0397 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1165-0397
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1165-0397
  • 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 1165-0397 available by request