C128-0105F Screening compound: N-(2-methoxy-5-methylphenyl)-1-[(4-methoxyphenyl)amino]isoquinoline-4-carboxamide

C128-0105F Screening compound: N-(2-methoxy-5-methylphenyl)-1-[(4-methoxyphenyl)amino]isoquinoline-4-carboxamide
C128-0105F Screening compound: N-(2-methoxy-5-methylphenyl)-1-[(4-methoxyphenyl)amino]isoquinoline-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C128-0105F
N-(2-methoxy-5-methylphenyl)-1-[(4-methoxyphenyl)amino]isoquinoline-4-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

C128-0105F

Molecular Formula

C25H23N3O3 (C25 H23 N3 O3)

Compound Name

N-(2-methoxy-5-methylphenyl)-1-[(4-methoxyphenyl)amino]isoquinoline-4-carboxamide

IUPAC name

N-(2-methoxy-5-methylphenyl)-1-[(4-methoxyphenyl)amino]isoquinoline-4-carboxamide

SMILES

Cc(cc1)cc(NC(c(c2ccccc22)cnc2Nc(cc2)ccc2OC)=O)c1OC

InChI

InChI=1S/C25H23N3O3/c1-16-8-13-23(31-3)22(14-16)28-25(29)21-15-26-24(20-7-5-4-6-19(20)21)27-17-9-11-18(30-2)12-10-17/h4-15H,1-3H3,(H,26,27)(H,28,29)

InChI Key

UJUXLRGMWAKQIH-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.48

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.864

Distribution Coefficient, logD

4.860

Water Solubility, LogSw

-4.62

Polar Surface Area

56.224

Acid Dissociation Constant (pKa)

11.58

Base Dissociation Constant (pKb)

5.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.00

References: we are preparing a list of scientific research reports with C128-0105F chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C128-0105F?
Check Price and Availability of C128-0105F, 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 C128-0105F you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C128-0105F
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C128-0105F
  • 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 C128-0105F available by request