Y205-0628 Screening compound: propyl 2-{[(4-fluorophenyl)sulfonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Y205-0628 Screening compound: propyl 2-{[(4-fluorophenyl)sulfonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Y205-0628 Screening compound: propyl 2-{[(4-fluorophenyl)sulfonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y205-0628
propyl 2-{[(4-fluorophenyl)sulfonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-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

Y205-0628

Molecular Formula

C17H18FNO4S2 (C17 H18 FNO4 S2)

Compound Name

propyl 2-{[(4-fluorophenyl)sulfonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

IUPAC name

propyl 2-(4-fluorobenzenesulfonamido)-4H5H6H-cyclopenta[b]thiophene-3-carboxylate

SMILES

CCCOC(c1c(NS(c(cc2)ccc2F)(=O)=O)sc2c1CCC2)=O

InChI

InChI=1S/C17H18FNO4S2/c1-2-10-23-17(20)15-13-4-3-5-14(13)24-16(15)19-25(21,22)12-8-6-11(18)7-9-12/h6-9,19H,2-5,10H2,1H3

InChI Key

DOUAKBSRWKOBFT-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

383.46

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.110

Distribution Coefficient, logD

-2.367

Water Solubility, LogSw

-4.30

Polar Surface Area

62.017

Acid Dissociation Constant (pKa)

0.92

Base Dissociation Constant (pKb)

-15.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.29

Y205-0628 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y205-0628 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y205-0628?
Check Price and Availability of Y205-0628, 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 Y205-0628 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y205-0628
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y205-0628
  • 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 Y205-0628 available by request