C303-0070 Screening compound: ethyl 4-{7-methylthieno[2,3-b]quinoline-2-carbonyl}piperazine-1-carboxylate

C303-0070 Screening compound: ethyl 4-{7-methylthieno[2,3-b]quinoline-2-carbonyl}piperazine-1-carboxylate
C303-0070 Screening compound: ethyl 4-{7-methylthieno[2,3-b]quinoline-2-carbonyl}piperazine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C303-0070
ethyl 4-{7-methylthieno[2,3-b]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

C303-0070

Molecular Formula

C20H21N3O3S (C20 H21 N3 O3 S)

Compound Name

ethyl 4-{7-methylthieno[2,3-b]quinoline-2-carbonyl}piperazine-1-carboxylate

IUPAC name

ethyl 4-{7-methylthieno[23-b]quinoline-2-carbonyl}piperazine-1-carboxylate

SMILES

CCOC(N(CC1)CCN1C(c1cc2cc3ccc(C)cc3nc2s1)=O)=O

InChI

InChI=1S/C20H21N3O3S/c1-3-26-20(25)23-8-6-22(7-9-23)19(24)17-12-15-11-14-5-4-13(2)10-16(14)21-18(15)27-17/h4-5,10-12H,3,6-9H2,1-2H3

InChI Key

OPOXYNXXIJYIHM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14746323

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

383.47

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

4.232

Distribution Coefficient, logD

4.231

Water Solubility, LogSw

-4.45

Polar Surface Area

49.102

Acid Dissociation Constant (pKa)

27.72

Base Dissociation Constant (pKb)

4.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

C303-0070 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Human Receptors Annotated Library (5376 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C303-0070 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C303-0070?
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What is the minimum amount of C303-0070 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C303-0070
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C303-0070
  • 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 C303-0070 available by request