C201-0922 Screening compound: ethyl 2-(ethylsulfanyl)-4-[(phenylcarbamoyl)amino]-1,3-thiazole-5-carboxylate

C201-0922 Screening compound: ethyl 2-(ethylsulfanyl)-4-[(phenylcarbamoyl)amino]-1,3-thiazole-5-carboxylate
C201-0922 Screening compound: ethyl 2-(ethylsulfanyl)-4-[(phenylcarbamoyl)amino]-1,3-thiazole-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C201-0922
ethyl 2-(ethylsulfanyl)-4-[(phenylcarbamoyl)amino]-1,3-thiazole-5-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

C201-0922

Molecular Formula

C15H17N3O3S2 (C15 H17 N3 O3 S2)

Compound Name

ethyl 2-(ethylsulfanyl)-4-[(phenylcarbamoyl)amino]-1,3-thiazole-5-carboxylate

IUPAC name

ethyl 2-(ethylsulfanyl)-4-[(phenylcarbamoyl)amino]-13-thiazole-5-carboxylate

SMILES

CCOC(c1c(NC(Nc2ccccc2)=O)nc(SCC)s1)=O

InChI

InChI=1S/C15H17N3O3S2/c1-3-21-13(19)11-12(18-15(23-11)22-4-2)17-14(20)16-10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3,(H2,16,17,20)

InChI Key

NJYWJXMCTCRNOU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14729536

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

351.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.431

Distribution Coefficient, logD

4.352

Water Solubility, LogSw

-4.11

Polar Surface Area

63.301

Acid Dissociation Constant (pKa)

8.10

Base Dissociation Constant (pKb)

1.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

C201-0922 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with C201-0922 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C201-0922?
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What is the minimum amount of C201-0922 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C201-0922
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C201-0922
  • 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 C201-0922 available by request