G610-0390 Screening compound: 3-(4-bromophenyl)-8-[(4-methylphenyl)methyl]-1,4,8-triazaspiro[4.5]dec-3-en-2-one

G610-0390 Screening compound: 3-(4-bromophenyl)-8-[(4-methylphenyl)methyl]-1,4,8-triazaspiro[4.5]dec-3-en-2-one
G610-0390 Screening compound: 3-(4-bromophenyl)-8-[(4-methylphenyl)methyl]-1,4,8-triazaspiro[4.5]dec-3-en-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G610-0390
3-(4-bromophenyl)-8-[(4-methylphenyl)methyl]-1,4,8-triazaspiro[4.5]dec-3-en-2-one

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

G610-0390

Molecular Formula

C21H22BrN3O (C21 H22 BrN3 O)

Compound Name

3-(4-bromophenyl)-8-[(4-methylphenyl)methyl]-1,4,8-triazaspiro[4.5]dec-3-en-2-one

IUPAC name

3-(4-bromophenyl)-8-[(4-methylphenyl)methyl]-148-triazaspiro[4.5]dec-3-en-2-one

SMILES

Cc1ccc(CN(CC2)CCC2(NC2=O)N=C2c(cc2)ccc2Br)cc1

InChI

InChI=1S/C21H22BrN3O/c1-15-2-4-16(5-3-15)14-25-12-10-21(11-13-25)23-19(20(26)24-21)17-6-8-18(22)9-7-17/h2-9H,10-14H2,1H3,(H,24,26)

InChI Key

YZISUQGRKWYHDW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27146351

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.33

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.955

Distribution Coefficient, logD

1.885

Water Solubility, LogSw

-3.94

Polar Surface Area

37.322

Acid Dissociation Constant (pKa)

9.36

Base Dissociation Constant (pKb)

9.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

G610-0390 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

KRAS-Targeted Library (16000 compounds)

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Anti-HIV1 Library (19540 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • Epigenetic
  • PPI modulators
  • PPI modulators
Targets:
  • Kinases
Structure:
  • Cyclic compounds
  • Cyclic compounds

References: we are preparing a list of scientific research reports with G610-0390 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G610-0390?
Check Price and Availability of G610-0390, 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 G610-0390 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G610-0390
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G610-0390
  • 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 G610-0390 available by request