G008-5166 Screening compound: methyl 4-[5-(3-methyl-1,2-oxazol-5-yl)-2-(propan-2-yl)benzenesulfonamido]benzoate

G008-5166 Screening compound: methyl 4-[5-(3-methyl-1,2-oxazol-5-yl)-2-(propan-2-yl)benzenesulfonamido]benzoate
G008-5166 Screening compound: methyl 4-[5-(3-methyl-1,2-oxazol-5-yl)-2-(propan-2-yl)benzenesulfonamido]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound G008-5166
methyl 4-[5-(3-methyl-1,2-oxazol-5-yl)-2-(propan-2-yl)benzenesulfonamido]benzoate

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

G008-5166

Molecular Formula

C21H22N2O5S (C21 H22 N2 O5 S)

Compound Name

methyl 4-[5-(3-methyl-1,2-oxazol-5-yl)-2-(propan-2-yl)benzenesulfonamido]benzoate

IUPAC name

methyl 4-[5-(3-methyl-12-oxazol-5-yl)-2-(propan-2-yl)benzenesulfonamido]benzoate

SMILES

CC(C)c(ccc(-c1cc(C)no1)c1)c1S(Nc(cc1)ccc1C(OC)=O)(=O)=O

InChI

InChI=1S/C21H22N2O5S/c1-13(2)18-10-7-16(19-11-14(3)22-28-19)12-20(18)29(25,26)23-17-8-5-15(6-9-17)21(24)27-4/h5-13,23H,1-4H3

InChI Key

BFJIGXKCWVIVHK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14976243

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.48

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.698

Distribution Coefficient, logD

3.388

Water Solubility, LogSw

-4.42

Polar Surface Area

83.404

Acid Dissociation Constant (pKa)

6.11

Base Dissociation Constant (pKb)

-2.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

G008-5166 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

SH2 Library (10483 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with G008-5166 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G008-5166?
Check Price and Availability of G008-5166, 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 G008-5166 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G008-5166
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G008-5166
  • 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 G008-5166 available by request