C611-0446 Screening compound: 3-amino-6-benzyl-N-(4-chlorophenyl)-5H,6H,7H,8H-thieno[2,3-b]1,6-naphthyridine-2-carboxamide

C611-0446 Screening compound: 3-amino-6-benzyl-N-(4-chlorophenyl)-5H,6H,7H,8H-thieno[2,3-b]1,6-naphthyridine-2-carboxamide
C611-0446 Screening compound: 3-amino-6-benzyl-N-(4-chlorophenyl)-5H,6H,7H,8H-thieno[2,3-b]1,6-naphthyridine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C611-0446
3-amino-6-benzyl-N-(4-chlorophenyl)-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

C611-0446

Molecular Formula

C24H21ClN4OS (C24 H21 ClN4 OS)

Compound Name

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

IUPAC name

3-amino-6-benzyl-N-(4-chlorophenyl)-5H6H7H8H-thieno[23-b]16-naphthyridine-2-carboxamide

SMILES

Nc1c(C(Nc(cc2)ccc2Cl)=O)sc2c1cc(CN(Cc1ccccc1)CC1)c1n2

InChI

InChI=1S/C24H21ClN4OS/c25-17-6-8-18(9-7-17)27-23(30)22-21(26)19-12-16-14-29(13-15-4-2-1-3-5-15)11-10-20(16)28-24(19)31-22/h1-9,12H,10-11,13-14,26H2,(H,27,30)

InChI Key

KELZNQUFXXKEPZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03685744

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448.98

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.975

Distribution Coefficient, logD

4.961

Water Solubility, LogSw

-5.14

Polar Surface Area

57.332

Acid Dissociation Constant (pKa)

10.53

Base Dissociation Constant (pKb)

5.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

C611-0446 in Drug Discovery

Included in Screening Libraries

Therapeutical Diversity Annotated Library (7563 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C611-0446 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C611-0446?
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What is the minimum amount of C611-0446 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C611-0446
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C611-0446
  • 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 C611-0446 available by request