7756-0009 Screening compound: 1-(4-bromophenyl)-2-(2-oxo-1,2-dihydropyridin-1-yl)-3-(piperidin-1-yl)propane-1,3-dione

7756-0009 Screening compound: 1-(4-bromophenyl)-2-(2-oxo-1,2-dihydropyridin-1-yl)-3-(piperidin-1-yl)propane-1,3-dione
7756-0009 Screening compound: 1-(4-bromophenyl)-2-(2-oxo-1,2-dihydropyridin-1-yl)-3-(piperidin-1-yl)propane-1,3-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 7756-0009
1-(4-bromophenyl)-2-(2-oxo-1,2-dihydropyridin-1-yl)-3-(piperidin-1-yl)propane-1,3-dione

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

7756-0009

Molecular Formula

C19H19BrN2O3 (C19 H19 BrN2 O3)

Compound Name

1-(4-bromophenyl)-2-(2-oxo-1,2-dihydropyridin-1-yl)-3-(piperidin-1-yl)propane-1,3-dione

IUPAC name

1-(4-bromophenyl)-2-(2-oxo-12-dihydropyridin-1-yl)-3-(piperidin-1-yl)propane-13-dione

SMILES

O=C(C(C(N1CCCCC1)=O)N(C=CC=C1)C1=O)c(cc1)ccc1Br

InChI

InChI=1S/C19H19BrN2O3/c20-15-9-7-14(8-10-15)18(24)17(22-13-5-2-6-16(22)23)19(25)21-11-3-1-4-12-21/h2,5-10,13,17H,1,3-4,11-12H2/t17-/m0/s1

InChI Key

YVGMSFASRYOKQS-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD08676000

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.28

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.527

Distribution Coefficient, logD

2.527

Water Solubility, LogSw

-2.55

Polar Surface Area

45.744

Acid Dissociation Constant (pKa)

11.63

Base Dissociation Constant (pKb)

-2.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.60

7756-0009 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 7756-0009 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7756-0009?
Check Price and Availability of 7756-0009, 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 7756-0009 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7756-0009
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7756-0009
  • 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 7756-0009 available by request