1646-0149 Screening compound: 3-(2-chloro-10H-phenothiazin-10-yl)propanenitrile

1646-0149 Screening compound: 3-(2-chloro-10H-phenothiazin-10-yl)propanenitrile
1646-0149 Screening compound: 3-(2-chloro-10H-phenothiazin-10-yl)propanenitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 1646-0149
3-(2-chloro-10H-phenothiazin-10-yl)propanenitrile

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

1646-0149

Molecular Formula

C15H11ClN2S (C15 H11 ClN2 S)

Compound Name

3-(2-chloro-10H-phenothiazin-10-yl)propanenitrile

IUPAC name

3-(2-chloro-10H-phenothiazin-10-yl)propanenitrile

SMILES

N#CCCN1c(cc(cc2)Cl)c2Sc2c1cccc2

InChI

InChI=1S/C15H11ClN2S/c16-11-6-7-15-13(10-11)18(9-3-8-17)12-4-1-2-5-14(12)19-15/h1-2,4-7,10H,3,9H2

InChI Key

BUHZIQWDEWOJBM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00158896

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

286.78

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

4.727

Distribution Coefficient, logD

4.727

Water Solubility, LogSw

-4.81

Polar Surface Area

19.027

Acid Dissociation Constant (pKa)

21.05

Base Dissociation Constant (pKb)

-4.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

1646-0149 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 1646-0149 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1646-0149?
Check Price and Availability of 1646-0149, 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 1646-0149 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1646-0149
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1646-0149
  • 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 1646-0149 available by request