G115-0301 Screening compound: 6-CHLORO-4-[5-(3,4-DIMETHYL-1,2-OXAZOL-5-YL)-2-METHYLBENZENESULFONYL]-3,4-DIHYDRO-2H-1,4-BENZOXAZINE

G115-0301 Screening compound: 6-CHLORO-4-[5-(3,4-DIMETHYL-1,2-OXAZOL-5-YL)-2-METHYLBENZENESULFONYL]-3,4-DIHYDRO-2H-1,4-BENZOXAZINE
G115-0301 Screening compound: 6-CHLORO-4-[5-(3,4-DIMETHYL-1,2-OXAZOL-5-YL)-2-METHYLBENZENESULFONYL]-3,4-DIHYDRO-2H-1,4-BENZOXAZINE alternative view

Chemical Structure Depiction of ChemDiv screening compound G115-0301
6-CHLORO-4-[5-(3,4-DIMETHYL-1,2-OXAZOL-5-YL)-2-METHYLBENZENESULFONYL]-3,4-DIHYDRO-2H-1,4-BENZOXAZINE

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

G115-0301

Molecular Formula

C20H19ClN2O4S (C20 H19 ClN2 O4 S)

Compound Name

6-CHLORO-4-[5-(3,4-DIMETHYL-1,2-OXAZOL-5-YL)-2-METHYLBENZENESULFONYL]-3,4-DIHYDRO-2H-1,4-BENZOXAZINE

IUPAC name

n/a

SMILES

Cc1c(-c2cc(S(N3c(cc(cc4)Cl)c4OCC3)(=O)=O)c(C)cc2)onc1C

InChI

InChI=1S/C20H19ClN2O4S/c1-12-4-5-15(20-13(2)14(3)22-27-20)10-19(12)28(24,25)23-8-9-26-18-7-6-16(21)11-17(18)23/h4-7,10-11H,8-9H2,1-3H3

InChI Key

HQAIMPQSEYNZIM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14980803

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.9

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.685

Distribution Coefficient, logD

4.685

Water Solubility, LogSw

-4.78

Polar Surface Area

61.687

Acid Dissociation Constant (pKa)

23.77

Base Dissociation Constant (pKb)

-1.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

G115-0301 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Inflammatory Library (24602 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G115-0301 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G115-0301?
Check Price and Availability of G115-0301, 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 G115-0301 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G115-0301
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G115-0301
  • 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 G115-0301 available by request