C593-0070 Screening compound: ethyl 4-{4-chlorothieno[3,2-c]quinoline-2-carbonyl}piperazine-1-carboxylate

C593-0070 Screening compound: ethyl 4-{4-chlorothieno[3,2-c]quinoline-2-carbonyl}piperazine-1-carboxylate
C593-0070 Screening compound: ethyl 4-{4-chlorothieno[3,2-c]quinoline-2-carbonyl}piperazine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C593-0070
ethyl 4-{4-chlorothieno[3,2-c]quinoline-2-carbonyl}piperazine-1-carboxylate

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

C593-0070

Molecular Formula

C19H18ClN3O3S (C19 H18 ClN3 O3 S)

Compound Name

ethyl 4-{4-chlorothieno[3,2-c]quinoline-2-carbonyl}piperazine-1-carboxylate

IUPAC name

ethyl 4-{4-chlorothieno[32-c]quinoline-2-carbonyl}piperazine-1-carboxylate

SMILES

CCOC(N(CC1)CCN1C(c1cc(c(Cl)nc2ccccc22)c2s1)=O)=O

InChI

InChI=1S/C19H18ClN3O3S/c1-2-26-19(25)23-9-7-22(8-10-23)18(24)15-11-13-16(27-15)12-5-3-4-6-14(12)21-17(13)20/h3-6,11H,2,7-10H2,1H3

InChI Key

DVXNSYBCVPSOCW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14773362

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.89

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.119

Distribution Coefficient, logD

4.119

Water Solubility, LogSw

-4.38

Polar Surface Area

49.382

Acid Dissociation Constant (pKa)

29.94

Base Dissociation Constant (pKb)

-0.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

C593-0070 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C593-0070 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C593-0070?
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What is the minimum amount of C593-0070 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C593-0070
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C593-0070
  • 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 C593-0070 available by request