M072-0510 Screening compound: ethyl 2-({[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]carbamoyl}amino)propanoate

M072-0510 Screening compound: ethyl 2-({[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]carbamoyl}amino)propanoate
M072-0510 Screening compound: ethyl 2-({[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]carbamoyl}amino)propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound M072-0510
ethyl 2-({[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]carbamoyl}amino)propanoate

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

M072-0510

Molecular Formula

C16H21N3O5S2 (C16 H21 N3 O5 S2)

Compound Name

ethyl 2-({[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]carbamoyl}amino)propanoate

IUPAC name

ethyl 2-({[2-(propane-2-sulfonyl)-13-benzothiazol-6-yl]carbamoyl}amino)propanoate

SMILES

CCOC(C(C)NC(Nc(cc1)cc(s2)c1nc2S(C(C)C)(=O)=O)=O)=O

InChI

InChI=1S/C16H21N3O5S2/c1-5-24-14(20)10(4)17-15(21)18-11-6-7-12-13(8-11)25-16(19-12)26(22,23)9(2)3/h6-10H,5H2,1-4H3,(H2,17,18,21)/t10-/m0/s1

InChI Key

YRDIUYQJZSNSCE-JTQLQIEISA-N

MDL Number (MFCD)

MFCD27496038

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.49

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.763

Distribution Coefficient, logD

2.763

Water Solubility, LogSw

-3.45

Polar Surface Area

93.320

Acid Dissociation Constant (pKa)

12.81

Base Dissociation Constant (pKb)

-0.41

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

43.80

M072-0510 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Nucleoside Mimetics Library (2197 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Cancer
  • Immune system
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with M072-0510 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M072-0510?
Check Price and Availability of M072-0510, 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 M072-0510 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M072-0510
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M072-0510
  • 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 M072-0510 available by request