8018-9202 Screening compound: N-(3-pyridylmethyl)(3-thienyl)methanamine

8018-9202 Screening compound: N-(3-pyridylmethyl)(3-thienyl)methanamine
8018-9202 Screening compound: N-(3-pyridylmethyl)(3-thienyl)methanamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-9202
N-(3-pyridylmethyl)(3-thienyl)methanamine

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

8018-9202

Molecular Formula

C11H12N2S (C11 H12 N2 S)

Compound Name

N-(3-pyridylmethyl)(3-thienyl)methanamine

IUPAC name

[(pyridin-3-yl)methyl][(thiophen-3-yl)methyl]amine

SMILES

C(c1cscc1)NCc1cnccc1

InChI

InChI=1S/C11H12N2S/c1-2-10(6-12-4-1)7-13-8-11-3-5-14-9-11/h1-6,9,13H,7-8H2

InChI Key

ULSFSZFNGXBRHK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07411595

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

204.3

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

1.459

Distribution Coefficient, logD

-0.161

Water Solubility, LogSw

-1.11

Polar Surface Area

22.540

Acid Dissociation Constant (pKa)

24.71

Base Dissociation Constant (pKb)

9.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.18

8018-9202 in Drug Discovery

Included in Screening Libraries

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

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 8018-9202 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-9202?
Check Price and Availability of 8018-9202, 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 8018-9202 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-9202
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-9202
  • 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 8018-9202 available by request