V012-6661 Screening compound: N~1~-[1-(1-benzoyl-4-piperidyl)-2-oxo-2-(propylamino)ethyl]-3-methylbutanamide
Chemical Structure Depiction of ChemDiv screening compound V012-6661
N~1~-[1-(1-benzoyl-4-piperidyl)-2-oxo-2-(propylamino)ethyl]-3-methylbutanamide
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
V012-6661
Molecular Formula
C22H33N3O3 (C22 H33 N3 O3)
Compound Name
N~1~-[1-(1-benzoyl-4-piperidyl)-2-oxo-2-(propylamino)ethyl]-3-methylbutanamide
IUPAC name
N-[(1-benzoylpiperidin-4-yl)(propylcarbamoyl)methyl]-3-methylbutanamide
SMILES
CCCNC(C(C(CC1)CCN1C(c1ccccc1)=O)NC(CC(C)C)=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
387.52
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
11.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
2.480
Distribution Coefficient, logD
2.480
Water Solubility, LogSw
-2.69
Polar Surface Area
65.237
Acid Dissociation Constant (pKa)
13.06
Base Dissociation Constant (pKb)
1.65
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
59.10
V012-6661 in Drug Discovery
Included in Screening Libraries
Antibacterial Compounds Library (13827 compounds)
Included in 1.7M Stock Database
- Infections
- Immune system
- animal
References: we are preparing a list of scientific research reports with V012-6661 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)