C593-0787 Screening compound: 5-ethyl-2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-4H,5H-thieno[3,2-c]quinolin-4-one

C593-0787 Screening compound: 5-ethyl-2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-4H,5H-thieno[3,2-c]quinolin-4-one
C593-0787 Screening compound: 5-ethyl-2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-4H,5H-thieno[3,2-c]quinolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C593-0787
5-ethyl-2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-4H,5H-thieno[3,2-c]quinolin-4-one

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

C593-0787

Molecular Formula

C25H25N3O3S (C25 H25 N3 O3 S)

Compound Name

5-ethyl-2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-4H,5H-thieno[3,2-c]quinolin-4-one

IUPAC name

5-ethyl-2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-4H5H-thieno[32-c]quinolin-4-one

SMILES

CCN(c(cccc1)c1-c1c2cc(C(N(CC3)CCN3c(cc3)ccc3OC)=O)s1)C2=O

InChI

InChI=1S/C25H25N3O3S/c1-3-28-21-7-5-4-6-19(21)23-20(24(28)29)16-22(32-23)25(30)27-14-12-26(13-15-27)17-8-10-18(31-2)11-9-17/h4-11,16H,3,12-15H2,1-2H3

InChI Key

FKHRFPIASGFWCS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14773729

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.56

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.344

Distribution Coefficient, logD

4.344

Water Solubility, LogSw

-4.31

Polar Surface Area

43.537

Acid Dissociation Constant (pKa)

27.38

Base Dissociation Constant (pKb)

7.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.00

C593-0787 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C593-0787 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C593-0787?
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What is the minimum amount of C593-0787 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C593-0787
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C593-0787
  • 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 C593-0787 available by request