2693-0081 Screening compound: 2-oxo-2-(10H-phenothiazin-10-yl)ethyl 4-methyl-2-(phenylformamido)pentanoate

2693-0081 Screening compound: 2-oxo-2-(10H-phenothiazin-10-yl)ethyl 4-methyl-2-(phenylformamido)pentanoate
2693-0081 Screening compound: 2-oxo-2-(10H-phenothiazin-10-yl)ethyl 4-methyl-2-(phenylformamido)pentanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 2693-0081
2-oxo-2-(10H-phenothiazin-10-yl)ethyl 4-methyl-2-(phenylformamido)pentanoate

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

2693-0081

Molecular Formula

C27H26N2O4S (C27 H26 N2 O4 S)

Compound Name

2-oxo-2-(10H-phenothiazin-10-yl)ethyl 4-methyl-2-(phenylformamido)pentanoate

IUPAC name

2-oxo-2-(10H-phenothiazin-10-yl)ethyl 4-methyl-2-(phenylformamido)pentanoate

SMILES

CC(C)CC(C(OCC(N1c(cccc2)c2Sc2c1cccc2)=O)=O)NC(c1ccccc1)=O

InChI

InChI=1S/C27H26N2O4S/c1-18(2)16-20(28-26(31)19-10-4-3-5-11-19)27(32)33-17-25(30)29-21-12-6-8-14-23(21)34-24-15-9-7-13-22(24)29/h3-15,18,20H,16-17H2,1-2H3,(H,28,31)/t20-/m0/s1

InChI Key

PYMUACCUAOWONC-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD01304482

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.58

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.715

Distribution Coefficient, logD

4.715

Water Solubility, LogSw

-4.32

Polar Surface Area

58.787

Acid Dissociation Constant (pKa)

11.54

Base Dissociation Constant (pKb)

-3.24

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.20

2693-0081 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

CORONAVIRUS Library (20774 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with 2693-0081 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2693-0081?
Check Price and Availability of 2693-0081, 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 2693-0081 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2693-0081
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2693-0081
  • 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 2693-0081 available by request