5594-3153 Screening compound: quinolin-8-yl 10H-phenothiazine-10-carboxylate

5594-3153 Screening compound: quinolin-8-yl 10H-phenothiazine-10-carboxylate
5594-3153 Screening compound: quinolin-8-yl 10H-phenothiazine-10-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 5594-3153
quinolin-8-yl 10H-phenothiazine-10-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

5594-3153

Molecular Formula

C22H14N2O2S (C22 H14 N2 O2 S)

Compound Name

quinolin-8-yl 10H-phenothiazine-10-carboxylate

IUPAC name

quinolin-8-yl 10H-phenothiazine-10-carboxylate

SMILES

O=C(N1c(cccc2)c2Sc2c1cccc2)Oc1cccc2cccnc12

InChI

InChI=1S/C22H14N2O2S/c25-22(26-18-11-5-7-15-8-6-14-23-21(15)18)24-16-9-1-3-12-19(16)27-20-13-4-2-10-17(20)24/h1-14H

InChI Key

NLNZDWCHKNKLDG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03190467

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.046

Distribution Coefficient, logD

5.046

Water Solubility, LogSw

-5.10

Polar Surface Area

29.438

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

2.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

5594-3153 in Drug Discovery

Included in Screening Libraries

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

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 5594-3153 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5594-3153?
Check Price and Availability of 5594-3153, 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 5594-3153 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5594-3153
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5594-3153
  • 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 5594-3153 available by request