C138-0700 Screening compound: N-(4-FLUOROPHENYL)-1-(2-METHOXYANILINO)-4-ISOQUINOLINECARBOXAMIDE

C138-0700 Screening compound: N-(4-FLUOROPHENYL)-1-(2-METHOXYANILINO)-4-ISOQUINOLINECARBOXAMIDE
C138-0700 Screening compound: N-(4-FLUOROPHENYL)-1-(2-METHOXYANILINO)-4-ISOQUINOLINECARBOXAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound C138-0700
N-(4-FLUOROPHENYL)-1-(2-METHOXYANILINO)-4-ISOQUINOLINECARBOXAMIDE

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

C138-0700

Molecular Formula

C23H18FN3O2 (C23 H18 FN3 O2)

Compound Name

N-(4-FLUOROPHENYL)-1-(2-METHOXYANILINO)-4-ISOQUINOLINECARBOXAMIDE

IUPAC name

n/a

SMILES

COc(cccc1)c1Nc1ncc(C(Nc(cc2)ccc2F)=O)c2ccccc12

InChI

InChI=1S/C23H18FN3O2/c1-29-21-9-5-4-8-20(21)27-22-18-7-3-2-6-17(18)19(14-25-22)23(28)26-16-12-10-15(24)11-13-16/h2-14H,1H3,(H,25,27)(H,26,28)

InChI Key

BMMTYKSHNOAPGN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14722100

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.41

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.945

Distribution Coefficient, logD

4.836

Water Solubility, LogSw

-4.72

Polar Surface Area

48.680

Acid Dissociation Constant (pKa)

11.05

Base Dissociation Constant (pKb)

6.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.30

References: we are preparing a list of scientific research reports with C138-0700 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C138-0700?
Check Price and Availability of C138-0700, 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 C138-0700 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C138-0700
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C138-0700
  • 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 C138-0700 available by request