K891-0297 Screening compound: propyl 3-amino-4-(4-methylphenyl)-5H,6H,7H,8H-thieno[2,3-b]quinoline-2-carboxylate

K891-0297 Screening compound: propyl 3-amino-4-(4-methylphenyl)-5H,6H,7H,8H-thieno[2,3-b]quinoline-2-carboxylate
K891-0297 Screening compound: propyl 3-amino-4-(4-methylphenyl)-5H,6H,7H,8H-thieno[2,3-b]quinoline-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound K891-0297
propyl 3-amino-4-(4-methylphenyl)-5H,6H,7H,8H-thieno[2,3-b]quinoline-2-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

K891-0297

Molecular Formula

C22H24N2O2S (C22 H24 N2 O2 S)

Compound Name

propyl 3-amino-4-(4-methylphenyl)-5H,6H,7H,8H-thieno[2,3-b]quinoline-2-carboxylate

IUPAC name

propyl 3-amino-4-(4-methylphenyl)-5H6H7H8H-thieno[23-b]quinoline-2-carboxylate

SMILES

CCCOC(c(sc1nc(CCCC2)c2c(-c2ccc(C)cc2)c11)c1N)=O

InChI

InChI=1S/C22H24N2O2S/c1-3-12-26-22(25)20-19(23)18-17(14-10-8-13(2)9-11-14)15-6-4-5-7-16(15)24-21(18)27-20/h8-11H,3-7,12,23H2,1-2H3

InChI Key

OXCYBLQRMLSKHV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03668018

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.51

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.238

Distribution Coefficient, logD

5.975

Water Solubility, LogSw

-5.78

Polar Surface Area

51.543

Acid Dissociation Constant (pKa)

18.37

Base Dissociation Constant (pKb)

7.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

K891-0297 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with K891-0297 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K891-0297?
Check Price and Availability of K891-0297, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of K891-0297 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K891-0297
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K891-0297
  • 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 K891-0297 available by request