E730-1976 Screening compound: ethyl 2-[2-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetate

E730-1976 Screening compound: ethyl 2-[2-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetate
E730-1976 Screening compound: ethyl 2-[2-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound E730-1976
ethyl 2-[2-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetate

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

E730-1976

Molecular Formula

C23H27NO4S (C23 H27 NO4 S)

Compound Name

ethyl 2-[2-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetate

IUPAC name

ethyl 2-[2-(5678-tetrahydronaphthalene-2-sulfonyl)-1234-tetrahydroisoquinolin-1-yl]acetate

SMILES

CCOC(CC(c1c(CC2)cccc1)N2S(c1cc(CCCC2)c2cc1)(=O)=O)=O

InChI

InChI=1S/C23H27NO4S/c1-2-28-23(25)16-22-21-10-6-5-8-18(21)13-14-24(22)29(26,27)20-12-11-17-7-3-4-9-19(17)15-20/h5-6,8,10-12,15,22H,2-4,7,9,13-14,16H2,1H3/t22-/m0/s1

InChI Key

FBZZQPSICJXAOX-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD14913320

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.54

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.040

Distribution Coefficient, logD

5.040

Water Solubility, LogSw

-4.58

Polar Surface Area

52.004

Acid Dissociation Constant (pKa)

22.87

Base Dissociation Constant (pKb)

-4.95

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

43.50

References: we are preparing a list of scientific research reports with E730-1976 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E730-1976?
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What is the minimum amount of E730-1976 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E730-1976
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E730-1976
  • 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 E730-1976 available by request