G069-0484 Screening compound: 1,3,3-trimethyl-N-({1-[(4-methylphenyl)methyl]piperidin-4-yl}methyl)-2-oxo-2,3-dihydro-1H-indole-5-sulfonamide
Chemical Structure Depiction of ChemDiv screening compound G069-0484
1,3,3-trimethyl-N-({1-[(4-methylphenyl)methyl]piperidin-4-yl}methyl)-2-oxo-2,3-dihydro-1H-indole-5-sulfonamide
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
G069-0484
Molecular Formula
C25H33N3O3S (C25 H33 N3 O3 S)
Compound Name
1,3,3-trimethyl-N-({1-[(4-methylphenyl)methyl]piperidin-4-yl}methyl)-2-oxo-2,3-dihydro-1H-indole-5-sulfonamide
IUPAC name
133-trimethyl-N-({1-[(4-methylphenyl)methyl]piperidin-4-yl}methyl)-2-oxo-23-dihydro-1H-indole-5-sulfonamide
SMILES
CC(C)(c(cc(cc1)S(NCC2CCN(Cc3ccc(C)cc3)CC2)(=O)=O)c1N1C)C1=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
455.62
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
4.037
Distribution Coefficient, logD
1.744
Water Solubility, LogSw
-4.12
Polar Surface Area
61.235
Acid Dissociation Constant (pKa)
11.48
Base Dissociation Constant (pKb)
9.69
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
48.00
G069-0484 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
Anticancer Library (62698 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
GPCR Targeted Library (31838 compounds)
Neurotransmitter Transporter Inhibitors Library (11024 compounds)
Aurora A-B Kinases Targeted Library (9426 compounds)
Included in 1.7M Stock Database
- Cancer
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- Nervous system
- Cancer
- Digestive system
- Male
- Female
- Hemic and lymphatic
- GPCR
- GPCR
- Ion Channels
- Kinases
- Receptor's ligands
References: we are preparing a list of scientific research reports with G069-0484 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)