6143-0208 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(thiophene-2-sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide

6143-0208 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(thiophene-2-sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
6143-0208 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(thiophene-2-sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6143-0208
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(thiophene-2-sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide

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

6143-0208

Molecular Formula

C24H26N2O5S2 (C24 H26 N2 O5 S2)

Compound Name

N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(thiophene-2-sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide

IUPAC name

N-[2-(34-dimethoxyphenyl)ethyl]-2-(thiophene-2-sulfonyl)-1234-tetrahydroisoquinoline-3-carboxamide

SMILES

COc(ccc(CCNC(C(Cc1c(C2)cccc1)N2S(c1cccs1)(=O)=O)=O)c1)c1OC

InChI

InChI=1S/C24H26N2O5S2/c1-30-21-10-9-17(14-22(21)31-2)11-12-25-24(27)20-15-18-6-3-4-7-19(18)16-26(20)33(28,29)23-8-5-13-32-23/h3-10,13-14,20H,11-12,15-16H2,1-2H3,(H,25,27)/t20-/m0/s1

InChI Key

CXKNNOAYEXCNTO-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD03821151

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

486.61

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.258

Distribution Coefficient, logD

3.258

Water Solubility, LogSw

-3.47

Polar Surface Area

72.616

Acid Dissociation Constant (pKa)

12.35

Base Dissociation Constant (pKb)

-2.28

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.20

6143-0208 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 6143-0208 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6143-0208?
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What is the minimum amount of 6143-0208 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6143-0208
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6143-0208
  • 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 6143-0208 available by request