L793-0654 Screening compound: 2-(1-methyl-1H-pyrrol-2-yl)-2-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide
Chemical Structure Depiction of ChemDiv screening compound L793-0654
2-(1-methyl-1H-pyrrol-2-yl)-2-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide
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
L793-0654
Molecular Formula
C17H20N2O5 (C17 H20 N2 O5)
Compound Name
2-(1-methyl-1H-pyrrol-2-yl)-2-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide
IUPAC name
2-(1-methyl-1H-pyrrol-2-yl)-2-oxo-N-[(345-trimethoxyphenyl)methyl]acetamide
SMILES
Cn1c(C(C(NCc(cc2OC)cc(OC)c2OC)=O)=O)ccc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
332.36
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
2.118
Distribution Coefficient, logD
2.118
Water Solubility, LogSw
-3.03
Polar Surface Area
63.785
Acid Dissociation Constant (pKa)
13.10
Base Dissociation Constant (pKb)
3.38
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
29.40
L793-0654 in Drug Discovery
Included in Screening Libraries
Anti-Aging Library (44940 compounds)
Antimitotic Tubulin Library (17355 compounds)
Covalent Inhibitors Library (7986 compounds)
SH2 PTB Focused Library (6188 compounds)
Included in 1.7M Stock Database
- Cancer
- Musculoskeletal
- Metabolic
- Immune system
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Male
- Female
- Hemic and lymphatic
- Skin
- Epigenetic
- Cyclic compounds
- 3D
- Fragments
References: we are preparing a list of scientific research reports with L793-0654 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)