C066-3427 Screening compound: 2-[(2-chloro-6-methyl-4-quinolyl)sulfanyl]-N~1~-[3-(diethylamino)propyl]acetamide

C066-3427 Screening compound: 2-[(2-chloro-6-methyl-4-quinolyl)sulfanyl]-N~1~-[3-(diethylamino)propyl]acetamide
C066-3427 Screening compound: 2-[(2-chloro-6-methyl-4-quinolyl)sulfanyl]-N~1~-[3-(diethylamino)propyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C066-3427
2-[(2-chloro-6-methyl-4-quinolyl)sulfanyl]-N~1~-[3-(diethylamino)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

C066-3427

Molecular Formula

C19H26ClN3OS (C19 H26 ClN3 OS)

Compound Name

2-[(2-chloro-6-methyl-4-quinolyl)sulfanyl]-N~1~-[3-(diethylamino)propyl]acetamide

IUPAC name

n/a

SMILES

CCN(CC)CCCNC(CSc1cc(Cl)nc2ccc(C)cc12)=O

InChI

InChI=1S/C19H26ClN3OS/c1-4-23(5-2)10-6-9-21-19(24)13-25-17-12-18(20)22-16-8-7-14(3)11-15(16)17/h7-8,11-12H,4-6,9-10,13H2,1-3H3,(H,21,24)

InChI Key

BVZHFYQIPBDUJB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14715605

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

379.95

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.679

Distribution Coefficient, logD

0.900

Water Solubility, LogSw

-3.95

Polar Surface Area

36.160

Acid Dissociation Constant (pKa)

15.69

Base Dissociation Constant (pKb)

10.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.40

C066-3427 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with C066-3427 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C066-3427?
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What is the minimum amount of C066-3427 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C066-3427
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C066-3427
  • 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 C066-3427 available by request