G008-4853 Screening compound: 1-[2-ethyl-5-(3-methyl-1,2-oxazol-5-yl)benzenesulfonyl]-3-[(4-fluorophenyl)methyl]-1,3-diazinane

G008-4853 Screening compound: 1-[2-ethyl-5-(3-methyl-1,2-oxazol-5-yl)benzenesulfonyl]-3-[(4-fluorophenyl)methyl]-1,3-diazinane
G008-4853 Screening compound: 1-[2-ethyl-5-(3-methyl-1,2-oxazol-5-yl)benzenesulfonyl]-3-[(4-fluorophenyl)methyl]-1,3-diazinane alternative view

Chemical Structure Depiction of ChemDiv screening compound G008-4853
1-[2-ethyl-5-(3-methyl-1,2-oxazol-5-yl)benzenesulfonyl]-3-[(4-fluorophenyl)methyl]-1,3-diazinane

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

G008-4853

Molecular Formula

C23H26FN3O3S (C23 H26 FN3 O3 S)

Compound Name

1-[2-ethyl-5-(3-methyl-1,2-oxazol-5-yl)benzenesulfonyl]-3-[(4-fluorophenyl)methyl]-1,3-diazinane

IUPAC name

1-[2-ethyl-5-(3-methyl-12-oxazol-5-yl)benzenesulfonyl]-3-[(4-fluorophenyl)methyl]-13-diazinane

SMILES

CCc(ccc(-c1cc(C)no1)c1)c1S(N1CN(Cc(cc2)ccc2F)CCC1)(=O)=O

InChI

InChI=1S/C23H26FN3O3S/c1-3-19-7-8-20(22-13-17(2)25-30-22)14-23(19)31(28,29)27-12-4-11-26(16-27)15-18-5-9-21(24)10-6-18/h5-10,13-14H,3-4,11-12,15-16H2,1-2H3

InChI Key

HBIYGCQLYQHSAG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14976159

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.54

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.481

Distribution Coefficient, logD

4.479

Water Solubility, LogSw

-4.17

Polar Surface Area

57.571

Acid Dissociation Constant (pKa)

24.76

Base Dissociation Constant (pKb)

5.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

G008-4853 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

CNS targets activity set (6557 compounds)

Human GPCR Annotated Library (5539 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with G008-4853 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G008-4853?
Check Price and Availability of G008-4853, 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 G008-4853 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G008-4853
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G008-4853
  • 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 G008-4853 available by request