P752-0113 Screening compound: 1-[2-(dimethylamino)ethyl]-6-oxo-N-[(thiophen-2-yl)methyl]-1,6-dihydropyridine-3-carboxamide

P752-0113 Screening compound: 1-[2-(dimethylamino)ethyl]-6-oxo-N-[(thiophen-2-yl)methyl]-1,6-dihydropyridine-3-carboxamide
P752-0113 Screening compound: 1-[2-(dimethylamino)ethyl]-6-oxo-N-[(thiophen-2-yl)methyl]-1,6-dihydropyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P752-0113
1-[2-(dimethylamino)ethyl]-6-oxo-N-[(thiophen-2-yl)methyl]-1,6-dihydropyridine-3-carboxamide

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

P752-0113

Molecular Formula

C15H19N3O2S (C15 H19 N3 O2 S)

Compound Name

1-[2-(dimethylamino)ethyl]-6-oxo-N-[(thiophen-2-yl)methyl]-1,6-dihydropyridine-3-carboxamide

IUPAC name

1-[2-(dimethylamino)ethyl]-6-oxo-N-[(thiophen-2-yl)methyl]-16-dihydropyridine-3-carboxamide

SMILES

CN(C)CCN(C=C(C=C1)C(NCc2cccs2)=O)C1=O

InChI

InChI=1S/C15H19N3O2S/c1-17(2)7-8-18-11-12(5-6-14(18)19)15(20)16-10-13-4-3-9-21-13/h3-6,9,11H,7-8,10H2,1-2H3,(H,16,20)

InChI Key

MINGTWDVAGAYHS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27614154

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

305.4

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

0.751

Distribution Coefficient, logD

0.014

Water Solubility, LogSw

-2.08

Polar Surface Area

46.297

Acid Dissociation Constant (pKa)

10.29

Base Dissociation Constant (pKb)

8.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

P752-0113 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

CNS MPO Library (28609 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system

References: we are preparing a list of scientific research reports with P752-0113 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P752-0113?
Check Price and Availability of P752-0113, 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 P752-0113 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P752-0113
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P752-0113
  • 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 P752-0113 available by request