3672-0026 Screening compound: 1-(1H-1,3-benzodiazol-1-yl)-3-[2-(prop-2-en-1-yl)phenoxy]propan-2-ol
Chemical Structure Depiction of ChemDiv screening compound 3672-0026
1-(1H-1,3-benzodiazol-1-yl)-3-[2-(prop-2-en-1-yl)phenoxy]propan-2-ol
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
3672-0026
Molecular Formula
C19H20N2O2 (C19 H20 N2 O2)
Compound Name
1-(1H-1,3-benzodiazol-1-yl)-3-[2-(prop-2-en-1-yl)phenoxy]propan-2-ol
IUPAC name
1-(1H-13-benzodiazol-1-yl)-3-[2-(prop-2-en-1-yl)phenoxy]propan-2-ol
SMILES
C=CCc(cccc1)c1OCC(Cn1c(cccc2)c2nc1)O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
308.38
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
3.784
Distribution Coefficient, logD
3.784
Water Solubility, LogSw
-4.02
Polar Surface Area
34.628
Acid Dissociation Constant (pKa)
16.48
Base Dissociation Constant (pKb)
3.86
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
21.10
3672-0026 in Drug Discovery
Included in Screening Libraries
Anti-Aging Library (44940 compounds)
STING Agonist Library (5895 compounds)
Serine Proteases Inhibitors Library (32732 compounds)
Adenosine Receptors Targeted Library (19896 compounds)
Included in 1.7M Stock Database
- Cancer
- Musculoskeletal
- Metabolic
- Immune system
- Cancer
- Immune system
- Infections
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Cardiovascular
- Skin
- Metabolic
- Immune system
- Cancer
- Digestive system
- Respiratory tract
- Nervous system
- Eye
- Cardiovascular
- Epigenetic
- Receptor's ligands
- Others
- Proteases
- GPCR
References: we are preparing a list of scientific research reports with 3672-0026 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)