6637-1091 Screening compound: (3E)-3-({1-[2-(2-methylphenoxy)ethyl]-1H-indol-3-yl}methylidene)-1-phenyl-2,3-dihydro-1H-indol-2-one
Chemical Structure Depiction of ChemDiv screening compound 6637-1091
(3E)-3-({1-[2-(2-methylphenoxy)ethyl]-1H-indol-3-yl}methylidene)-1-phenyl-2,3-dihydro-1H-indol-2-one
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
6637-1091
Molecular Formula
C32H26N2O2 (C32 H26 N2 O2)
Compound Name
(3E)-3-({1-[2-(2-methylphenoxy)ethyl]-1H-indol-3-yl}methylidene)-1-phenyl-2,3-dihydro-1H-indol-2-one
IUPAC name
(3E)-3-({1-[2-(2-methylphenoxy)ethyl]-1H-indol-3-yl}methylidene)-1-phenyl-23-dihydro-1H-indol-2-one
SMILES
Cc(cccc1)c1OCCn1c(cccc2)c2c(/C=C(\c(cccc2)c2N2c3ccccc3)/C2=O)c1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
470.57
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
6.516
Distribution Coefficient, logD
6.516
Water Solubility, LogSw
-5.86
Polar Surface Area
24.039
Acid Dissociation Constant (pKa)
28.32
Base Dissociation Constant (pKb)
-4.16
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
9.40
6637-1091 in Drug Discovery
Included in Screening Libraries
Antimitotic Tubulin Library (17355 compounds)
Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Male
- Female
- Hemic and lymphatic
- Skin
- Cancer
- Nervous system
- Male
- Female
- Hemic and lymphatic
- Skin
- Endocrine
- Phosphatases
References: we are preparing a list of scientific research reports with 6637-1091 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)