2154-0767 Screening compound: N-[5-(1,3-benzothiazol-2-yl)-2-methylphenyl]-4-butoxybenzamide
Chemical Structure Depiction of ChemDiv screening compound 2154-0767
N-[5-(1,3-benzothiazol-2-yl)-2-methylphenyl]-4-butoxybenzamide
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
2154-0767
Molecular Formula
C25H24N2O2S (C25 H24 N2 O2 S)
Compound Name
N-[5-(1,3-benzothiazol-2-yl)-2-methylphenyl]-4-butoxybenzamide
IUPAC name
N-[5-(13-benzothiazol-2-yl)-2-methylphenyl]-4-butoxybenzamide
SMILES
CCCCOc(cc1)ccc1C(Nc1c(C)ccc(-c2nc(cccc3)c3s2)c1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
416.54
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
6.739
Distribution Coefficient, logD
6.738
Water Solubility, LogSw
-5.58
Polar Surface Area
39.498
Acid Dissociation Constant (pKa)
11.78
Base Dissociation Constant (pKb)
0.88
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
20.00
2154-0767 in Drug Discovery
Included in Screening Libraries
Lipid Metabolism Library (9174 compounds)
Therapeutical Diversity Annotated Library (7563 compounds)
Histone Deacetylases (HDAC) Targeted Library (9760 compounds)
Included in 1.7M Stock Database
- Cardiovascular
- Metabolic
- Cancer
- Nervous system
- Hemic and lymphatic
- Endocrine
- Immune system
- Epigenetic
References: we are preparing a list of scientific research reports with 2154-0767 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)