M713-0187 Screening compound: {1-[2-(dimethylamino)ethyl]-2,5-dimethyl-1H-pyrrol-3-yl}(piperidino)methanone

M713-0187 Screening compound: {1-[2-(dimethylamino)ethyl]-2,5-dimethyl-1H-pyrrol-3-yl}(piperidino)methanone
M713-0187 Screening compound: {1-[2-(dimethylamino)ethyl]-2,5-dimethyl-1H-pyrrol-3-yl}(piperidino)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound M713-0187
{1-[2-(dimethylamino)ethyl]-2,5-dimethyl-1H-pyrrol-3-yl}(piperidino)methanone

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

M713-0187

Molecular Formula

C16H27N3O (C16 H27 N3 O)

Compound Name

{1-[2-(dimethylamino)ethyl]-2,5-dimethyl-1H-pyrrol-3-yl}(piperidino)methanone

IUPAC name

{2-[25-dimethyl-3-(piperidine-1-carbonyl)-1H-pyrrol-1-yl]ethyl}dimethylamine

SMILES

Cc1cc(C(N2CCCCC2)=O)c(C)n1CCN(C)C

InChI

InChI=1S/C16H27N3O/c1-13-12-15(14(2)19(13)11-10-17(3)4)16(20)18-8-6-5-7-9-18/h12H,5-11H2,1-4H3

InChI Key

VHARCIYKMNYVMA-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

277.41

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.699

Distribution Coefficient, logD

1.244

Water Solubility, LogSw

-2.07

Polar Surface Area

22.924

Acid Dissociation Constant (pKa)

27.87

Base Dissociation Constant (pKb)

7.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

68.75

M713-0187 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with M713-0187 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M713-0187?
Check Price and Availability of M713-0187, 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 M713-0187 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M713-0187
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M713-0187
  • 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 M713-0187 available by request