G008-2554 Screening compound: N-[(2-ethoxyphenyl)methyl]-2-methyl-5-(3-methyl-1,2-oxazol-5-yl)benzene-1-sulfonamide

G008-2554 Screening compound: N-[(2-ethoxyphenyl)methyl]-2-methyl-5-(3-methyl-1,2-oxazol-5-yl)benzene-1-sulfonamide
G008-2554 Screening compound: N-[(2-ethoxyphenyl)methyl]-2-methyl-5-(3-methyl-1,2-oxazol-5-yl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G008-2554
N-[(2-ethoxyphenyl)methyl]-2-methyl-5-(3-methyl-1,2-oxazol-5-yl)benzene-1-sulfonamide

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

G008-2554

Molecular Formula

C20H22N2O4S (C20 H22 N2 O4 S)

Compound Name

N-[(2-ethoxyphenyl)methyl]-2-methyl-5-(3-methyl-1,2-oxazol-5-yl)benzene-1-sulfonamide

IUPAC name

N-[(2-ethoxyphenyl)methyl]-2-methyl-5-(3-methyl-12-oxazol-5-yl)benzene-1-sulfonamide

SMILES

CCOc1c(CNS(c2c(C)ccc(-c3cc(C)no3)c2)(=O)=O)cccc1

InChI

InChI=1S/C20H22N2O4S/c1-4-25-18-8-6-5-7-17(18)13-21-27(23,24)20-12-16(10-9-14(20)2)19-11-15(3)22-26-19/h5-12,21H,4,13H2,1-3H3

InChI Key

VILXVMODAYMGFY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14975406

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.47

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.364

Distribution Coefficient, logD

4.362

Water Solubility, LogSw

-4.21

Polar Surface Area

70.549

Acid Dissociation Constant (pKa)

9.82

Base Dissociation Constant (pKb)

-2.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

G008-2554 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with G008-2554 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G008-2554?
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What is the minimum amount of G008-2554 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G008-2554
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G008-2554
  • 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 G008-2554 available by request