G211-0232 Screening compound: methyl 3-{2-cyclohexyl-3-oxo-1H,2H,3H-pyrrolo[3,4-b]quinoline-9-amido}thiophene-2-carboxylate
Chemical Structure Depiction of ChemDiv screening compound G211-0232
methyl 3-{2-cyclohexyl-3-oxo-1H,2H,3H-pyrrolo[3,4-b]quinoline-9-amido}thiophene-2-carboxylate
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
G211-0232
Molecular Formula
C24H23N3O4S (C24 H23 N3 O4 S)
Compound Name
methyl 3-{2-cyclohexyl-3-oxo-1H,2H,3H-pyrrolo[3,4-b]quinoline-9-amido}thiophene-2-carboxylate
IUPAC name
methyl 3-{2-cyclohexyl-3-oxo-1H2H3H-pyrrolo[34-b]quinoline-9-amido}thiophene-2-carboxylate
SMILES
COC(c(scc1)c1NC(c1c(CN(C2CCCCC2)C2=O)c2nc2ccccc12)=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
449.53
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
4.434
Distribution Coefficient, logD
3.442
Water Solubility, LogSw
-4.46
Polar Surface Area
70.050
Acid Dissociation Constant (pKa)
6.45
Base Dissociation Constant (pKb)
-2.03
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
33.30
G211-0232 in Drug Discovery
Included in Screening Libraries
Allosteric Kinases Inhibitors Library (23117 compounds)
Angiogenesis library (14822 compounds)
Anti-infective Library (19449 compounds)
Anticancer Library (62698 compounds)
Antiviral HBV Library (10007 compounds)
Antiviral Library (67538 compounds)
Included in 1.7M Stock Database
- Cancer
- Female
- Congenital
- Skin
- Cancer
- Infections
- Immune system
- animal
- Cancer
- Antiviral
- Infections
- Immune system
- Antiviral
- Infections
- Immune system
- Kinases
References: we are preparing a list of scientific research reports with G211-0232 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)