G537-2234 Screening compound: 4-[(Z)-({[2-(adamantan-1-ylsulfanyl)ethyl]amino}({[(oxolan-2-yl)methyl]amino})methylidene)amino]benzoic acid

G537-2234 Screening compound: 4-[(Z)-({[2-(adamantan-1-ylsulfanyl)ethyl]amino}({[(oxolan-2-yl)methyl]amino})methylidene)amino]benzoic acid
G537-2234 Screening compound: 4-[(Z)-({[2-(adamantan-1-ylsulfanyl)ethyl]amino}({[(oxolan-2-yl)methyl]amino})methylidene)amino]benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound G537-2234
4-[(Z)-({[2-(adamantan-1-ylsulfanyl)ethyl]amino}({[(oxolan-2-yl)methyl]amino})methylidene)amino]benzoic acid

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

G537-2234

Molecular Formula

C25H35N3O3S (C25 H35 N3 O3 S)

Compound Name

4-[(Z)-({[2-(adamantan-1-ylsulfanyl)ethyl]amino}({[(oxolan-2-yl)methyl]amino})methylidene)amino]benzoic acid

IUPAC name

4-[(Z)-({[2-(adamantan-1-ylsulfanyl)ethyl]amino}({[(oxolan-2-yl)methyl]amino})methylidene)amino]benzoic acid

SMILES

OC(c(cc1)ccc1/N=C(\NCCSC1(CC(C2)C3)CC3CC2C1)/NCC1OCCC1)=O

InChI

InChI=1S/C25H35N3O3S/c29-23(30)20-3-5-21(6-4-20)28-24(27-16-22-2-1-8-31-22)26-7-9-32-25-13-17-10-18(14-25)12-19(11-17)15-25/h3-6,17-19,22H,1-2,7-16H2,(H,29,30)(H2,26,27,28)/t17?,18?,19?,22-,25?/m1/s1

InChI Key

OKDDEMLGIMWYHV-VBSWXYJSSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

CF3COOH

Molecular Weight

457.64

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.567

Distribution Coefficient, logD

4.567

Water Solubility, LogSw

-4.37

Polar Surface Area

65.932

Acid Dissociation Constant (pKa)

4.01

Base Dissociation Constant (pKb)

8.02

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

68.00

G537-2234 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G537-2234 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G537-2234?
Check Price and Availability of G537-2234, 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 G537-2234 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G537-2234
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G537-2234
  • 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 G537-2234 available by request