1183-1459 Screening compound: (3E)-4-(pyridin-4-yl)but-3-en-2-ol

1183-1459 Screening compound: (3E)-4-(pyridin-4-yl)but-3-en-2-ol
1183-1459 Screening compound: (3E)-4-(pyridin-4-yl)but-3-en-2-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 1183-1459
(3E)-4-(pyridin-4-yl)but-3-en-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

1183-1459

Molecular Formula

C9H11NO (C9 H11 NO)

Compound Name

(3E)-4-(pyridin-4-yl)but-3-en-2-ol

IUPAC name

n/a

SMILES

CC(/C=C/c1ccncc1)O

InChI

InChI=1S/C9H11NO/c1-8(11)2-3-9-4-6-10-7-5-9/h2-8,11H,1H3/b3-2+/t8-/m0/s1

InChI Key

PTUMRDMEAMXLMC-SGJFDWMWSA-N

MDL Number (MFCD)

MFCD00634471

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

149.19

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

1.287

Distribution Coefficient, logD

1.287

Water Solubility, LogSw

-0.60

Polar Surface Area

26.145

Acid Dissociation Constant (pKa)

14.86

Base Dissociation Constant (pKb)

3.77

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.20

1183-1459 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments
  • Pool

References: we are preparing a list of scientific research reports with 1183-1459 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1183-1459?
Check Price and Availability of 1183-1459, 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 1183-1459 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1183-1459
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1183-1459
  • 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 1183-1459 available by request