5786-1106 Screening compound: 2-(2-benzyl-1H-1,3-benzodiazol-1-yl)-N-(2,6-diethylphenyl)-N-(methoxymethyl)acetamide
Chemical Structure Depiction of ChemDiv screening compound 5786-1106
2-(2-benzyl-1H-1,3-benzodiazol-1-yl)-N-(2,6-diethylphenyl)-N-(methoxymethyl)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
5786-1106
Molecular Formula
C28H31N3O2 (C28 H31 N3 O2)
Compound Name
2-(2-benzyl-1H-1,3-benzodiazol-1-yl)-N-(2,6-diethylphenyl)-N-(methoxymethyl)acetamide
IUPAC name
2-(2-benzyl-1H-13-benzodiazol-1-yl)-N-(26-diethylphenyl)-N-(methoxymethyl)acetamide
SMILES
CCc1cccc(CC)c1N(COC)C(Cn1c(cccc2)c2nc1Cc1ccccc1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
441.57
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
10.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
6.247
Distribution Coefficient, logD
6.245
Water Solubility, LogSw
-5.57
Polar Surface Area
34.536
Acid Dissociation Constant (pKa)
16.27
Base Dissociation Constant (pKb)
5.11
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
28.60
5786-1106 in Drug Discovery
Included in Screening Libraries
PI3K-Targeted Library (17255 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Male
- Female
- Hemic and lymphatic
- Skin
- Kinases
References: we are preparing a list of scientific research reports with 5786-1106 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)