7174-0080 Screening compound: 1-(ethylsulfanyl)-6,7-dimethoxy-3,3-dimethyl-3,4-dihydroisoquinoline

7174-0080 Screening compound: 1-(ethylsulfanyl)-6,7-dimethoxy-3,3-dimethyl-3,4-dihydroisoquinoline
7174-0080 Screening compound: 1-(ethylsulfanyl)-6,7-dimethoxy-3,3-dimethyl-3,4-dihydroisoquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound 7174-0080
1-(ethylsulfanyl)-6,7-dimethoxy-3,3-dimethyl-3,4-dihydroisoquinoline

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

7174-0080

Molecular Formula

C15H21NO2S (C15 H21 NO2 S)

Compound Name

1-(ethylsulfanyl)-6,7-dimethoxy-3,3-dimethyl-3,4-dihydroisoquinoline

IUPAC name

1-(ethylsulfanyl)-67-dimethoxy-33-dimethyl-34-dihydroisoquinoline

SMILES

CCSC1=NC(C)(C)Cc(cc2OC)c1cc2OC

InChI

InChI=1S/C15H21NO2S/c1-6-19-14-11-8-13(18-5)12(17-4)7-10(11)9-15(2,3)16-14/h7-8H,6,9H2,1-5H3

InChI Key

ZJVDPVXKIZPONE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06618459

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

279.4

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.332

Distribution Coefficient, logD

3.264

Water Solubility, LogSw

-3.49

Polar Surface Area

23.791

Acid Dissociation Constant (pKa)

25.98

Base Dissociation Constant (pKb)

6.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.30

7174-0080 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 7174-0080 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7174-0080?
Check Price and Availability of 7174-0080, 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 7174-0080 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7174-0080
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7174-0080
  • 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 7174-0080 available by request