M373-0945 Screening compound: 2-cyclohexyl-1-(3-{2-[(2-methylphenyl)amino]pyrimidin-4-yl}piperidin-1-yl)ethan-1-one
Chemical Structure Depiction of ChemDiv screening compound M373-0945
2-cyclohexyl-1-(3-{2-[(2-methylphenyl)amino]pyrimidin-4-yl}piperidin-1-yl)ethan-1-one
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
M373-0945
Molecular Formula
C24H32N4O (C24 H32 N4 O)
Compound Name
2-cyclohexyl-1-(3-{2-[(2-methylphenyl)amino]pyrimidin-4-yl}piperidin-1-yl)ethan-1-one
IUPAC name
2-cyclohexyl-1-(3-{2-[(2-methylphenyl)amino]pyrimidin-4-yl}piperidin-1-yl)ethan-1-one
SMILES
Cc(cccc1)c1Nc1nccc(C(CCC2)CN2C(CC2CCCCC2)=O)n1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
392.54
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
5.001
Distribution Coefficient, logD
4.999
Water Solubility, LogSw
-4.61
Polar Surface Area
44.565
Acid Dissociation Constant (pKa)
18.67
Base Dissociation Constant (pKb)
5.02
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
54.20
M373-0945 in Drug Discovery
Included in Screening Libraries
3D-Diversity Natural-Product-Like Library (18102 compounds)
CNS BBB Library (22607 compounds)
GPCR Targeted Library (31838 compounds)
Aurora A-B Kinases Targeted Library (9426 compounds)
Included in 1.7M Stock Database
- 3D
- Nervous system
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- Cancer
- Digestive system
- Male
- Female
- Hemic and lymphatic
- GPCR
- Kinases
- Receptor's ligands
References: we are preparing a list of scientific research reports with M373-0945 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)