C498-0702 Screening compound: N-[(2,4-dimethoxyphenyl)methyl]-5-methyl-4-oxo-4H,5H-thieno[3,2-c]quinoline-2-carboxamide

C498-0702 Screening compound: N-[(2,4-dimethoxyphenyl)methyl]-5-methyl-4-oxo-4H,5H-thieno[3,2-c]quinoline-2-carboxamide
C498-0702 Screening compound: N-[(2,4-dimethoxyphenyl)methyl]-5-methyl-4-oxo-4H,5H-thieno[3,2-c]quinoline-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C498-0702
N-[(2,4-dimethoxyphenyl)methyl]-5-methyl-4-oxo-4H,5H-thieno[3,2-c]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

C498-0702

Molecular Formula

C22H20N2O4S (C22 H20 N2 O4 S)

Compound Name

N-[(2,4-dimethoxyphenyl)methyl]-5-methyl-4-oxo-4H,5H-thieno[3,2-c]quinoline-2-carboxamide

IUPAC name

N-[(24-dimethoxyphenyl)methyl]-5-methyl-4-oxo-4H5H-thieno[32-c]quinoline-2-carboxamide

SMILES

CN(c(cccc1)c1-c1c2cc(C(NCc(ccc(OC)c3)c3OC)=O)s1)C2=O

InChI

InChI=1S/C22H20N2O4S/c1-24-17-7-5-4-6-15(17)20-16(22(24)26)11-19(29-20)21(25)23-12-13-8-9-14(27-2)10-18(13)28-3/h4-11H,12H2,1-3H3,(H,23,25)

InChI Key

WIFXGTVQHMYDRJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14762182

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.599

Distribution Coefficient, logD

3.599

Water Solubility, LogSw

-3.94

Polar Surface Area

55.713

Acid Dissociation Constant (pKa)

13.12

Base Dissociation Constant (pKb)

-5.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

References: we are preparing a list of scientific research reports with C498-0702 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C498-0702?
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What is the minimum amount of C498-0702 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C498-0702
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C498-0702
  • 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 C498-0702 available by request