8017-8484 Screening compound: 2-({[4-(5-oxotetrahydro-1H-pyrrol-3-yl)phenyl]sulfonyl}amino)-N~1~-(2-phenoxyethyl)benzamide

8017-8484 Screening compound: 2-({[4-(5-oxotetrahydro-1H-pyrrol-3-yl)phenyl]sulfonyl}amino)-N~1~-(2-phenoxyethyl)benzamide
8017-8484 Screening compound: 2-({[4-(5-oxotetrahydro-1H-pyrrol-3-yl)phenyl]sulfonyl}amino)-N~1~-(2-phenoxyethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-8484
2-({[4-(5-oxotetrahydro-1H-pyrrol-3-yl)phenyl]sulfonyl}amino)-N~1~-(2-phenoxyethyl)benzamide

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

8017-8484

Molecular Formula

C25H25N3O5S (C25 H25 N3 O5 S)

Compound Name

2-({[4-(5-oxotetrahydro-1H-pyrrol-3-yl)phenyl]sulfonyl}amino)-N~1~-(2-phenoxyethyl)benzamide

IUPAC name

2-[4-(5-oxopyrrolidin-3-yl)benzenesulfonamido]-N-(2-phenoxyethyl)benzamide

SMILES

O=C(c(cccc1)c1NS(c1ccc(C(C2)CNC2=O)cc1)(=O)=O)NCCOc1ccccc1

InChI

InChI=1S/C25H25N3O5S/c29-24-16-19(17-27-24)18-10-12-21(13-11-18)34(31,32)28-23-9-5-4-8-22(23)25(30)26-14-15-33-20-6-2-1-3-7-20/h1-13,19,28H,14-17H2,(H,26,30)(H,27,29)/t19-/m0/s1

InChI Key

JEWUUWVGXVKMEU-IBGZPJMESA-N

MDL Number (MFCD)

MFCD06618684

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.56

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.401

Distribution Coefficient, logD

2.392

Water Solubility, LogSw

-3.75

Polar Surface Area

97.104

Acid Dissociation Constant (pKa)

6.44

Base Dissociation Constant (pKb)

-2.36

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.00

8017-8484 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8017-8484 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of 8017-8484 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-8484
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-8484
  • 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 8017-8484 available by request