G525-0117 Screening compound: methyl 2-{6,7-dimethoxy-2-[(3-methylphenyl)carbamoyl]-1,2,3,4-tetrahydroisoquinolin-1-yl}acetate

G525-0117 Screening compound: methyl 2-{6,7-dimethoxy-2-[(3-methylphenyl)carbamoyl]-1,2,3,4-tetrahydroisoquinolin-1-yl}acetate
G525-0117 Screening compound: methyl 2-{6,7-dimethoxy-2-[(3-methylphenyl)carbamoyl]-1,2,3,4-tetrahydroisoquinolin-1-yl}acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound G525-0117
methyl 2-{6,7-dimethoxy-2-[(3-methylphenyl)carbamoyl]-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

G525-0117

Molecular Formula

C22H26N2O5 (C22 H26 N2 O5)

Compound Name

methyl 2-{6,7-dimethoxy-2-[(3-methylphenyl)carbamoyl]-1,2,3,4-tetrahydroisoquinolin-1-yl}acetate

IUPAC name

methyl 2-{67-dimethoxy-2-[(3-methylphenyl)carbamoyl]-1234-tetrahydroisoquinolin-1-yl}acetate

SMILES

Cc1cccc(NC(N(CC2)C(CC(OC)=O)c(cc3OC)c2cc3OC)=O)c1

InChI

InChI=1S/C22H26N2O5/c1-14-6-5-7-16(10-14)23-22(26)24-9-8-15-11-19(27-2)20(28-3)12-17(15)18(24)13-21(25)29-4/h5-7,10-12,18H,8-9,13H2,1-4H3,(H,23,26)/t18-/m0/s1

InChI Key

HZDIENLQSLXNDF-SFHVURJKSA-N

MDL Number (MFCD)

MFCD15015522

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.46

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.895

Distribution Coefficient, logD

2.895

Water Solubility, LogSw

-3.29

Polar Surface Area

60.746

Acid Dissociation Constant (pKa)

14.34

Base Dissociation Constant (pKb)

-0.86

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.40

References: we are preparing a list of scientific research reports with G525-0117 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G525-0117?
Check Price and Availability of G525-0117, 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 G525-0117 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G525-0117
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G525-0117
  • 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 G525-0117 available by request