C611-0505 Screening compound: 3-amino-N-(4-ethoxyphenyl)-6-(propan-2-yl)-5H,6H,7H,8H-thieno[2,3-b]1,6-naphthyridine-2-carboxamide

C611-0505 Screening compound: 3-amino-N-(4-ethoxyphenyl)-6-(propan-2-yl)-5H,6H,7H,8H-thieno[2,3-b]1,6-naphthyridine-2-carboxamide
C611-0505 Screening compound: 3-amino-N-(4-ethoxyphenyl)-6-(propan-2-yl)-5H,6H,7H,8H-thieno[2,3-b]1,6-naphthyridine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C611-0505
3-amino-N-(4-ethoxyphenyl)-6-(propan-2-yl)-5H,6H,7H,8H-thieno[2,3-b]1,6-naphthyridine-2-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

C611-0505

Molecular Formula

C22H26N4O2S (C22 H26 N4 O2 S)

Compound Name

3-amino-N-(4-ethoxyphenyl)-6-(propan-2-yl)-5H,6H,7H,8H-thieno[2,3-b]1,6-naphthyridine-2-carboxamide

IUPAC name

3-amino-N-(4-ethoxyphenyl)-6-(propan-2-yl)-5H6H7H8H-thieno[23-b]16-naphthyridine-2-carboxamide

SMILES

CCOc(cc1)ccc1NC(c(sc1nc(CCN(C2)C(C)C)c2cc11)c1N)=O

InChI

InChI=1S/C22H26N4O2S/c1-4-28-16-7-5-15(6-8-16)24-21(27)20-19(23)17-11-14-12-26(13(2)3)10-9-18(14)25-22(17)29-20/h5-8,11,13H,4,9-10,12,23H2,1-3H3,(H,24,27)

InChI Key

SMQJEURGHFXSHP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10086892

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.54

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.040

Distribution Coefficient, logD

3.734

Water Solubility, LogSw

-4.16

Polar Surface Area

64.779

Acid Dissociation Constant (pKa)

12.01

Base Dissociation Constant (pKb)

7.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

C611-0505 in Drug Discovery

Included in Screening Libraries

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with C611-0505 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C611-0505?
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What is the minimum amount of C611-0505 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C611-0505
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C611-0505
  • 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 C611-0505 available by request