C463-0048 Screening compound: 2-[(1-methyl-2-oxo-1,2-dihydroquinolin-4-yl)sulfanyl]-N-[3-(morpholin-4-yl)propyl]acetamide

C463-0048 Screening compound: 2-[(1-methyl-2-oxo-1,2-dihydroquinolin-4-yl)sulfanyl]-N-[3-(morpholin-4-yl)propyl]acetamide
C463-0048 Screening compound: 2-[(1-methyl-2-oxo-1,2-dihydroquinolin-4-yl)sulfanyl]-N-[3-(morpholin-4-yl)propyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C463-0048
2-[(1-methyl-2-oxo-1,2-dihydroquinolin-4-yl)sulfanyl]-N-[3-(morpholin-4-yl)propyl]acetamide

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

C463-0048

Molecular Formula

C19H25N3O3S (C19 H25 N3 O3 S)

Compound Name

2-[(1-methyl-2-oxo-1,2-dihydroquinolin-4-yl)sulfanyl]-N-[3-(morpholin-4-yl)propyl]acetamide

IUPAC name

2-[(1-methyl-2-oxo-12-dihydroquinolin-4-yl)sulfanyl]-N-[3-(morpholin-4-yl)propyl]acetamide

SMILES

CN(c(cccc1)c1C(SCC(NCCCN1CCOCC1)=O)=C1)C1=O

InChI

InChI=1S/C19H25N3O3S/c1-21-16-6-3-2-5-15(16)17(13-19(21)24)26-14-18(23)20-7-4-8-22-9-11-25-12-10-22/h2-3,5-6,13H,4,7-12,14H2,1H3,(H,20,23)

InChI Key

UUOFZOVYFLKGNI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14759947

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.508

Distribution Coefficient, logD

0.084

Water Solubility, LogSw

-2.33

Polar Surface Area

51.589

Acid Dissociation Constant (pKa)

15.91

Base Dissociation Constant (pKb)

7.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.40

C463-0048 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with C463-0048 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C463-0048?
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What is the minimum amount of C463-0048 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C463-0048
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C463-0048
  • 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 C463-0048 available by request