C270-0733 Screening compound: 3-({1-[(4-fluorophenyl)methyl]piperidin-4-yl}methyl)-1-(2-methoxyphenyl)urea
Chemical Structure Depiction of ChemDiv screening compound C270-0733
3-({1-[(4-fluorophenyl)methyl]piperidin-4-yl}methyl)-1-(2-methoxyphenyl)urea
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
C270-0733
Molecular Formula
C21H26FN3O2 (C21 H26 FN3 O2)
Compound Name
3-({1-[(4-fluorophenyl)methyl]piperidin-4-yl}methyl)-1-(2-methoxyphenyl)urea
IUPAC name
3-({1-[(4-fluorophenyl)methyl]piperidin-4-yl}methyl)-1-(2-methoxyphenyl)urea
SMILES
COc(cccc1)c1NC(NCC1CCN(Cc(cc2)ccc2F)CC1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
371.45
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
3.586
Distribution Coefficient, logD
1.797
Water Solubility, LogSw
-3.79
Polar Surface Area
44.529
Acid Dissociation Constant (pKa)
12.37
Base Dissociation Constant (pKb)
9.18
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
38.10
C270-0733 in Drug Discovery
Included in Screening Libraries
Anti-Aging Library (44940 compounds)
CNS BBB Library (22607 compounds)
Protein-Protein Interaction Library (218420 compounds)
Serine Proteases Inhibitors Library (32732 compounds)
Chemokine Receptor-Targeted Library (18382 compounds)
Included in 1.7M Stock Database
- Cancer
- Musculoskeletal
- Metabolic
- Immune system
- Nervous system
- Nervous system
- Infections
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Cardiovascular
- Skin
- Metabolic
- Immune system
- Immune system
- Epigenetic
- PPI modulators
- Receptor's ligands
- Proteases
References: we are preparing a list of scientific research reports with C270-0733 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)