V011-0276 Screening compound: N-{trans-4-[(4-fluorobenzoyl)(3-methylbenzyl)amino]cyclohexyl}-1-(phenylacetyl)-4-piperidinecarboxamide
Chemical Structure Depiction of ChemDiv screening compound V011-0276
N-{trans-4-[(4-fluorobenzoyl)(3-methylbenzyl)amino]cyclohexyl}-1-(phenylacetyl)-4-piperidinecarboxamide
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
V011-0276
Molecular Formula
C35H40FN3O3 (C35 H40 FN3 O3)
Compound Name
N-{trans-4-[(4-fluorobenzoyl)(3-methylbenzyl)amino]cyclohexyl}-1-(phenylacetyl)-4-piperidinecarboxamide
IUPAC name
1-(2-phenylacetyl)-N-[(1r4r)-4-{N-[(3-methylphenyl)methyl]4-fluorobenzamido}cyclohexyl]piperidine-4-carboxamide
SMILES
Cc1cccc(CN([C@H](CC2)CC[C@@H]2NC(C(CC2)CCN2C(Cc2ccccc2)=O)=O)C(c(cc2)ccc2F)=O)c1
InChI Key
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
569.72
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
11.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
5.087
Distribution Coefficient, logD
5.087
Water Solubility, LogSw
-5.01
Polar Surface Area
55.490
Acid Dissociation Constant (pKa)
15.04
Base Dissociation Constant (pKb)
5.98
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
40.00
V011-0276 in Drug Discovery
Included in Screening Libraries
Anticancer Library (62698 compounds)
GPCR Targeted Library (31838 compounds)
Included in 1.7M Stock Database
- Cancer
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- GPCR
- Receptor's ligands
References: we are preparing a list of scientific research reports with V011-0276 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)