5518-1638 Screening compound: 3-amino-N-(3,4-dimethoxyphenyl)-5H,6H,7H,8H-thieno[2,3-b]quinoline-2-carboxamide

5518-1638 Screening compound: 3-amino-N-(3,4-dimethoxyphenyl)-5H,6H,7H,8H-thieno[2,3-b]quinoline-2-carboxamide
5518-1638 Screening compound: 3-amino-N-(3,4-dimethoxyphenyl)-5H,6H,7H,8H-thieno[2,3-b]quinoline-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5518-1638
3-amino-N-(3,4-dimethoxyphenyl)-5H,6H,7H,8H-thieno[2,3-b]quinoline-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

5518-1638

Molecular Formula

C20H21N3O3S (C20 H21 N3 O3 S)

Compound Name

3-amino-N-(3,4-dimethoxyphenyl)-5H,6H,7H,8H-thieno[2,3-b]quinoline-2-carboxamide

IUPAC name

3-amino-N-(34-dimethoxyphenyl)-5H6H7H8H-thieno[23-b]quinoline-2-carboxamide

SMILES

COc(ccc(NC(c(sc1nc(CCCC2)c2cc11)c1N)=O)c1)c1OC

InChI

InChI=1S/C20H21N3O3S/c1-25-15-8-7-12(10-16(15)26-2)22-19(24)18-17(21)13-9-11-5-3-4-6-14(11)23-20(13)27-18/h7-10H,3-6,21H2,1-2H3,(H,22,24)

InChI Key

KCICWBIXEGUUKB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03235818

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

383.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.595

Distribution Coefficient, logD

3.581

Water Solubility, LogSw

-3.88

Polar Surface Area

69.119

Acid Dissociation Constant (pKa)

11.03

Base Dissociation Constant (pKb)

5.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

5518-1638 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 5518-1638 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5518-1638?
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What is the minimum amount of 5518-1638 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5518-1638
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5518-1638
  • 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 5518-1638 available by request