0620-0057 Screening compound: 2-[2-(N'-octadecanoylhydrazinecarbonyl)acetamido]benzoic acid
Chemical Structure Depiction of ChemDiv screening compound 0620-0057
2-[2-(N'-octadecanoylhydrazinecarbonyl)acetamido]benzoic 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
0620-0057
Molecular Formula
C28H45N3O5 (C28 H45 N3 O5)
Compound Name
2-[2-(N'-octadecanoylhydrazinecarbonyl)acetamido]benzoic acid
IUPAC name
2-[2-(N'-octadecanoylhydrazinecarbonyl)acetamido]benzoic acid
SMILES
CCCCCCCCCCCCCCCCCC(NNC(CC(Nc(cccc1)c1C(O)=O)=O)=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
503.68
Hydrogen Bond Acceptors Count
9.00
Hydrogen Bond Donors Count
4.00
Rotatable Bond Count
24.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
7.390
Distribution Coefficient, logD
2.977
Water Solubility, LogSw
-5.63
Polar Surface Area
102.139
Acid Dissociation Constant (pKa)
2.99
Base Dissociation Constant (pKb)
2.34
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
64.30
0620-0057 in Drug Discovery
Included in Screening Libraries
3CLpro Library (4801 compounds)
CORONAVIRUS Library (20774 compounds)
Lipid Metabolism Library (9174 compounds)
Regenerative Medicine Focused Library (23016 compounds)
Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
- Antiviral
- Infections
- Immune system
- Cardiovascular
- Metabolic
- Musculoskeletal
- Digestive system
- Hemic and lymphatic
- Cardiovascular
- Skin
- wounds
- Cancer
- Nervous system
- Male
- Female
- Hemic and lymphatic
- Skin
- Endocrine
- Phosphatases
References: we are preparing a list of scientific research reports with 0620-0057 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)