M103-0235 Screening compound: N-{3-[3-(piperidine-1-carbonyl)imidazo[2,1-b][1,3]thiazol-6-yl]phenyl}-4-(trifluoromethyl)benzamide
Chemical Structure Depiction of ChemDiv screening compound M103-0235
N-{3-[3-(piperidine-1-carbonyl)imidazo[2,1-b][1,3]thiazol-6-yl]phenyl}-4-(trifluoromethyl)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
M103-0235
Molecular Formula
C25H21F3N4O2S (C25 H21 F3 N4 O2 S)
Compound Name
N-{3-[3-(piperidine-1-carbonyl)imidazo[2,1-b][1,3]thiazol-6-yl]phenyl}-4-(trifluoromethyl)benzamide
IUPAC name
N-{3-[3-(piperidine-1-carbonyl)imidazo[21-b][13]thiazol-6-yl]phenyl}-4-(trifluoromethyl)benzamide
SMILES
O=C(c1csc2nc(-c3cc(NC(c4ccc(C(F)(F)F)cc4)=O)ccc3)cn12)N1CCCCC1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
498.53
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
5.519
Distribution Coefficient, logD
5.519
Water Solubility, LogSw
-5.72
Polar Surface Area
48.435
Acid Dissociation Constant (pKa)
11.77
Base Dissociation Constant (pKb)
-0.28
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
24.00
M103-0235 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Lipid Metabolism Library (9174 compounds)
Included in 1.7M Stock Database
- Cardiovascular
- Metabolic
References: we are preparing a list of scientific research reports with M103-0235 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)