V028-8086 Screening compound: N-[4-(4-cyclopentanecarbonylpiperazin-1-yl)-3-(piperidine-1-carbonyl)phenyl]cyclobutanecarboxamide
Chemical Structure Depiction of ChemDiv screening compound V028-8086
N-[4-(4-cyclopentanecarbonylpiperazin-1-yl)-3-(piperidine-1-carbonyl)phenyl]cyclobutanecarboxamide
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
V028-8086
Molecular Formula
C27H38N4O3 (C27 H38 N4 O3)
Compound Name
N-[4-(4-cyclopentanecarbonylpiperazin-1-yl)-3-(piperidine-1-carbonyl)phenyl]cyclobutanecarboxamide
IUPAC name
N-[4-(4-cyclopentanecarbonylpiperazin-1-yl)-3-(piperidine-1-carbonyl)phenyl]cyclobutanecarboxamide
SMILES
O=C(C1CCC1)Nc(cc1)cc(C(N2CCCCC2)=O)c1N(CC1)CCN1C(C1CCCC1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
not_available
Molecular Weight
466.62
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
3.027
Distribution Coefficient, logD
3.027
Water Solubility, LogSw
-3.51
Polar Surface Area
60.667
Acid Dissociation Constant (pKa)
12.44
Base Dissociation Constant (pKb)
6.80
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
66.70
V028-8086 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
GPCR Targeted Library (31838 compounds)
Included in 1.7M Stock Database
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- GPCR
- Receptor's ligands
References: we are preparing a list of scientific research reports with V028-8086 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)