G243-0493 Screening compound: 1-{[1,2,5-trimethyl-4-(piperidine-1-carbonyl)-1H-pyrrol-3-yl]sulfonyl}-1,2,3,4-tetrahydroquinoline
Chemical Structure Depiction of ChemDiv screening compound G243-0493
1-{[1,2,5-trimethyl-4-(piperidine-1-carbonyl)-1H-pyrrol-3-yl]sulfonyl}-1,2,3,4-tetrahydroquinoline
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
G243-0493
Molecular Formula
C22H29N3O3S (C22 H29 N3 O3 S)
Compound Name
1-{[1,2,5-trimethyl-4-(piperidine-1-carbonyl)-1H-pyrrol-3-yl]sulfonyl}-1,2,3,4-tetrahydroquinoline
IUPAC name
1-{[125-trimethyl-4-(piperidine-1-carbonyl)-1H-pyrrol-3-yl]sulfonyl}-1234-tetrahydroquinoline
SMILES
Cc1c(C(N2CCCCC2)=O)c(S(N(CCC2)c3c2cccc3)(=O)=O)c(C)n1C
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
415.56
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
2.372
Distribution Coefficient, logD
2.372
Water Solubility, LogSw
-2.51
Polar Surface Area
50.818
Acid Dissociation Constant (pKa)
24.92
Base Dissociation Constant (pKb)
-2.83
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
50.00
G243-0493 in Drug Discovery
Included in Screening Libraries
Antiviral Library (67538 compounds)
Adenosine Receptors Targeted Library (19896 compounds)
Neuropeptide S Library (2850 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
- Cancer
- Digestive system
- Respiratory tract
- Nervous system
- Eye
- Cardiovascular
- Digestive system
- Nervous system
- GPCR
- GPCR
- Receptor's ligands
- Receptor's ligands
References: we are preparing a list of scientific research reports with G243-0493 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)