8190-0184 Screening compound: 3-[(2-carboxy-1H-indol-3-yl)[4-(prop-2-en-1-yloxy)phenyl]methyl]-1H-indole-2-carboxylic acid
Chemical Structure Depiction of ChemDiv screening compound 8190-0184
3-[(2-carboxy-1H-indol-3-yl)[4-(prop-2-en-1-yloxy)phenyl]methyl]-1H-indole-2-carboxylic 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
8190-0184
Molecular Formula
C28H22N2O5 (C28 H22 N2 O5)
Compound Name
3-[(2-carboxy-1H-indol-3-yl)[4-(prop-2-en-1-yloxy)phenyl]methyl]-1H-indole-2-carboxylic acid
IUPAC name
3-[(2-carboxy-1H-indol-3-yl)[4-(prop-2-en-1-yloxy)phenyl]methyl]-1H-indole-2-carboxylic acid
SMILES
C=CCOc1ccc(C(c2c(C(O)=O)[nH]c3c2cccc3)c2c(C(O)=O)[nH]c3c2cccc3)cc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
466.49
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
4.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
4.451
Distribution Coefficient, logD
1.377
Water Solubility, LogSw
-4.36
Polar Surface Area
84.168
Acid Dissociation Constant (pKa)
4.33
Base Dissociation Constant (pKb)
-3.63
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
7.10
8190-0184 in Drug Discovery
Included in Screening Libraries
Autophagy-Targeted Library (4564 compounds)
Selective Target Activity Profiling Library (14702 compounds)
Antibacterial Compounds Library (13827 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Included in 1.7M Stock Database
- Infections
- Cancer
- Digestive system
- Respiratory tract
- Nervous system
- Male
- Female
- Cardiovascular
- Skin
- Metabolic
- Immune system
- Infections
- Immune system
- animal
References: we are preparing a list of scientific research reports with 8190-0184 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)