F788-0208 Screening compound: N-[1-(3,5-dimethylbenzenesulfonyl)piperidin-4-yl]-N-{[2-(thiophen-2-yl)-1,3-thiazol-4-yl]methyl}methanesulfonamide

F788-0208 Screening compound: N-[1-(3,5-dimethylbenzenesulfonyl)piperidin-4-yl]-N-{[2-(thiophen-2-yl)-1,3-thiazol-4-yl]methyl}methanesulfonamide
F788-0208 Screening compound: N-[1-(3,5-dimethylbenzenesulfonyl)piperidin-4-yl]-N-{[2-(thiophen-2-yl)-1,3-thiazol-4-yl]methyl}methanesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F788-0208
N-[1-(3,5-dimethylbenzenesulfonyl)piperidin-4-yl]-N-{[2-(thiophen-2-yl)-1,3-thiazol-4-yl]methyl}methanesulfonamide

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

F788-0208

Molecular Formula

C22H27N3O4S4 (C22 H27 N3 O4 S4)

Compound Name

N-[1-(3,5-dimethylbenzenesulfonyl)piperidin-4-yl]-N-{[2-(thiophen-2-yl)-1,3-thiazol-4-yl]methyl}methanesulfonamide

IUPAC name

N-[1-(35-dimethylbenzenesulfonyl)piperidin-4-yl]-N-{[2-(thiophen-2-yl)-13-thiazol-4-yl]methyl}methanesulfonamide

SMILES

Cc1cc(S(N(CC2)CCC2N(Cc2csc(-c3cccs3)n2)S(C)(=O)=O)(=O)=O)cc(C)c1

InChI

InChI=1S/C22H27N3O4S4/c1-16-11-17(2)13-20(12-16)33(28,29)24-8-6-19(7-9-24)25(32(3,26)27)14-18-15-31-22(23-18)21-5-4-10-30-21/h4-5,10-13,15,19H,6-9,14H2,1-3H3

InChI Key

XZJWGGQSXUNLLW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14966923

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

525.74

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.865

Distribution Coefficient, logD

4.865

Water Solubility, LogSw

-4.70

Polar Surface Area

74.156

Acid Dissociation Constant (pKa)

24.48

Base Dissociation Constant (pKb)

3.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

F788-0208 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 F788-0208 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F788-0208?
Check Price and Availability of F788-0208, 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 F788-0208 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F788-0208
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F788-0208
  • 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 F788-0208 available by request