C174-0317 Screening compound: N-[1-(1-butyl-1H-1,3-benzodiazol-2-yl)ethyl]benzamide
Chemical Structure Depiction of ChemDiv screening compound C174-0317
N-[1-(1-butyl-1H-1,3-benzodiazol-2-yl)ethyl]benzamide
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
C174-0317
Molecular Formula
C20H23N3O (C20 H23 N3 O)
Compound Name
N-[1-(1-butyl-1H-1,3-benzodiazol-2-yl)ethyl]benzamide
IUPAC name
N-[1-(1-butyl-1H-13-benzodiazol-2-yl)ethyl]benzamide
SMILES
CCCCn1c(cccc2)c2nc1C(C)NC(c1ccccc1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
321.42
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
4.189
Distribution Coefficient, logD
4.189
Water Solubility, LogSw
-3.88
Polar Surface Area
33.993
Acid Dissociation Constant (pKa)
10.45
Base Dissociation Constant (pKb)
3.09
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
30.00
C174-0317 in Drug Discovery
Included in Screening Libraries
3D-Biodiversity Library (27607 compounds)
CNS targets activity set (6557 compounds)
Serine Proteases Inhibitors Library (32732 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)
Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)
Included in 1.7M Stock Database
- 3D
- Infections
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Cardiovascular
- Skin
- Metabolic
- Immune system
- Cancer
- Digestive system
- Female
- Hemic and lymphatic
- Metabolic
- Immune system
- Proteases
- Others
References: we are preparing a list of scientific research reports with C174-0317 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)