E734-1882 Screening compound: 2-[6-(cyclopentylsulfamoyl)-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl]-N-(2,5-dimethoxyphenyl)acetamide

E734-1882 Screening compound: 2-[6-(cyclopentylsulfamoyl)-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl]-N-(2,5-dimethoxyphenyl)acetamide
E734-1882 Screening compound: 2-[6-(cyclopentylsulfamoyl)-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl]-N-(2,5-dimethoxyphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E734-1882
2-[6-(cyclopentylsulfamoyl)-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl]-N-(2,5-dimethoxyphenyl)acetamide

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

E734-1882

Molecular Formula

C23H27N3O7S (C23 H27 N3 O7 S)

Compound Name

2-[6-(cyclopentylsulfamoyl)-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl]-N-(2,5-dimethoxyphenyl)acetamide

IUPAC name

2-[6-(cyclopentylsulfamoyl)-3-oxo-34-dihydro-2H-14-benzoxazin-4-yl]-N-(25-dimethoxyphenyl)acetamide

SMILES

COc(cc1)cc(NC(CN2c(cc(cc3)S(NC4CCCC4)(=O)=O)c3OCC2=O)=O)c1OC

InChI

InChI=1S/C23H27N3O7S/c1-31-16-7-9-20(32-2)18(11-16)24-22(27)13-26-19-12-17(8-10-21(19)33-14-23(26)28)34(29,30)25-15-5-3-4-6-15/h7-12,15,25H,3-6,13-14H2,1-2H3,(H,24,27)

InChI Key

ZFJRTTJQXIODST-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14913618

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

489.55

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.636

Distribution Coefficient, logD

2.635

Water Solubility, LogSw

-3.27

Polar Surface Area

103.757

Acid Dissociation Constant (pKa)

10.09

Base Dissociation Constant (pKb)

1.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

E734-1882 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with E734-1882 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E734-1882?
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What is the minimum amount of E734-1882 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E734-1882
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E734-1882
  • 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 E734-1882 available by request