4782-0153 Screening compound: DIETHYL[4-(10H-PHENOTHIAZIN-10-YL)BUT-2-YN-1-YL]AMINE

4782-0153 Screening compound: DIETHYL[4-(10H-PHENOTHIAZIN-10-YL)BUT-2-YN-1-YL]AMINE
4782-0153 Screening compound: DIETHYL[4-(10H-PHENOTHIAZIN-10-YL)BUT-2-YN-1-YL]AMINE alternative view

Chemical Structure Depiction of ChemDiv screening compound 4782-0153
DIETHYL[4-(10H-PHENOTHIAZIN-10-YL)BUT-2-YN-1-YL]AMINE

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

4782-0153

Molecular Formula

C20H22N2S (C20 H22 N2 S)

Compound Name

DIETHYL[4-(10H-PHENOTHIAZIN-10-YL)BUT-2-YN-1-YL]AMINE

IUPAC name

n/a

SMILES

CCN(CC)CC#CCN1c(cccc2)c2Sc2c1cccc2

InChI

InChI=1S/C20H22N2S/c1-3-21(4-2)15-9-10-16-22-17-11-5-7-13-19(17)23-20-14-8-6-12-18(20)22/h5-8,11-14H,3-4,15-16H2,1-2H3

InChI Key

XSEMONHSGKQGTJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00568850

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

322.47

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.236

Distribution Coefficient, logD

4.319

Water Solubility, LogSw

-5.12

Polar Surface Area

4.946

Acid Dissociation Constant (pKa)

25.91

Base Dissociation Constant (pKb)

8.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

4782-0153 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Nucleic Acid Ligands (8311 compounds)

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system
Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with 4782-0153 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4782-0153?
Check Price and Availability of 4782-0153, 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 4782-0153 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4782-0153
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4782-0153
  • 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 4782-0153 available by request