G791-0935 Screening compound: N-[(2,4-dimethoxyphenyl)methyl]-2-(4-methylbenzenesulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide

G791-0935 Screening compound: N-[(2,4-dimethoxyphenyl)methyl]-2-(4-methylbenzenesulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
G791-0935 Screening compound: N-[(2,4-dimethoxyphenyl)methyl]-2-(4-methylbenzenesulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G791-0935
N-[(2,4-dimethoxyphenyl)methyl]-2-(4-methylbenzenesulfonyl)-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

G791-0935

Molecular Formula

C26H28N2O5S (C26 H28 N2 O5 S)

Compound Name

N-[(2,4-dimethoxyphenyl)methyl]-2-(4-methylbenzenesulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide

IUPAC name

N-[(24-dimethoxyphenyl)methyl]-2-(4-methylbenzenesulfonyl)-1234-tetrahydroisoquinoline-3-carboxamide

SMILES

Cc(cc1)ccc1S(N(Cc1c(C2)cccc1)C2C(NCc(ccc(OC)c1)c1OC)=O)(=O)=O

InChI

InChI=1S/C26H28N2O5S/c1-18-8-12-23(13-9-18)34(30,31)28-17-21-7-5-4-6-19(21)14-24(28)26(29)27-16-20-10-11-22(32-2)15-25(20)33-3/h4-13,15,24H,14,16-17H2,1-3H3,(H,27,29)/t24-/m0/s1

InChI Key

VSCDEWRUBOYZGA-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD27158356

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

480.58

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.573

Distribution Coefficient, logD

4.573

Water Solubility, LogSw

-4.39

Polar Surface Area

71.670

Acid Dissociation Constant (pKa)

11.51

Base Dissociation Constant (pKb)

-4.13

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.90

G791-0935 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Integrin Receptors Targeted library (1715 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with G791-0935 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G791-0935?
Check Price and Availability of G791-0935, 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 G791-0935 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G791-0935
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G791-0935
  • 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 G791-0935 available by request