C753-0534 Screening compound: 3-({[2-(1H-indol-3-yl)ethyl]amino}methyl)-1-[(4-methylphenyl)methyl]-1H-indole-2-carboxylic acid
Chemical Structure Depiction of ChemDiv screening compound C753-0534
3-({[2-(1H-indol-3-yl)ethyl]amino}methyl)-1-[(4-methylphenyl)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
C753-0534
Molecular Formula
C28H27N3O2 (C28 H27 N3 O2)
Compound Name
3-({[2-(1H-indol-3-yl)ethyl]amino}methyl)-1-[(4-methylphenyl)methyl]-1H-indole-2-carboxylic acid
IUPAC name
3-({[2-(1H-indol-3-yl)ethyl]amino}methyl)-1-[(4-methylphenyl)methyl]-1H-indole-2-carboxylic acid
SMILES
Cc1ccc(Cn2c(C(O)=O)c(CNCCc3c[nH]c4c3cccc4)c3c2cccc3)cc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
437.54
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
3.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
4.798
Distribution Coefficient, logD
4.798
Water Solubility, LogSw
-4.36
Polar Surface Area
50.355
Acid Dissociation Constant (pKa)
4.47
Base Dissociation Constant (pKb)
10.89
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
17.90
C753-0534 in Drug Discovery
Included in Screening Libraries
CORONAVIRUS Library (20774 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
References: we are preparing a list of scientific research reports with C753-0534 chemical compound. It will be published here after verification.
Frequently Asked Questions
Check Price and Availability of C753-0534, 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.
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)