F919-0277 Screening compound: ethyl 4-[4-(piperazin-1-yl)-3-(thiophene-2-sulfonamido)benzoyl]piperazine-1-carboxylate

F919-0277 Screening compound: ethyl 4-[4-(piperazin-1-yl)-3-(thiophene-2-sulfonamido)benzoyl]piperazine-1-carboxylate
F919-0277 Screening compound: ethyl 4-[4-(piperazin-1-yl)-3-(thiophene-2-sulfonamido)benzoyl]piperazine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound F919-0277
ethyl 4-[4-(piperazin-1-yl)-3-(thiophene-2-sulfonamido)benzoyl]piperazine-1-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

F919-0277

Molecular Formula

C22H29N5O5S2 (C22 H29 N5 O5 S2)

Compound Name

ethyl 4-[4-(piperazin-1-yl)-3-(thiophene-2-sulfonamido)benzoyl]piperazine-1-carboxylate

IUPAC name

ethyl 4-[4-(piperazin-1-yl)-3-(thiophene-2-sulfonamido)benzoyl]piperazine-1-carboxylate

SMILES

CCOC(N(CC1)CCN1C(c(cc1)cc(NS(c2cccs2)(=O)=O)c1N1CCNCC1)=O)=O

InChI

InChI=1S/C22H29N5O5S2/c1-2-32-22(29)27-13-11-26(12-14-27)21(28)17-5-6-19(25-9-7-23-8-10-25)18(16-17)24-34(30,31)20-4-3-15-33-20/h3-6,15-16,23-24H,2,7-14H2,1H3

InChI Key

HLGSNDUBDVPXBF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14971736

Chemical and Physical Properties

Saltdata

CF3COOH

Molecular Weight

507.63

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.554

Distribution Coefficient, logD

1.554

Water Solubility, LogSw

-2.57

Polar Surface Area

95.749

Acid Dissociation Constant (pKa)

7.10

Base Dissociation Constant (pKb)

8.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.50

F919-0277 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 F919-0277 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F919-0277?
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What is the minimum amount of F919-0277 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F919-0277
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F919-0277
  • 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 F919-0277 available by request