0134-0079 Screening compound: 1-[(benzylcarbamoyl)methyl]-3-[(E)-(hydroxyimino)methyl]pyridin-1-ium
Chemical Structure Depiction of ChemDiv screening compound 0134-0079
1-[(benzylcarbamoyl)methyl]-3-[(E)-(hydroxyimino)methyl]pyridin-1-ium
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
0134-0079
Molecular Formula
C15H16N3O2 (C15 H16 N3 O2)
Compound Name
1-[(benzylcarbamoyl)methyl]-3-[(E)-(hydroxyimino)methyl]pyridin-1-ium
IUPAC name
1-[(benzylcarbamoyl)methyl]-3-[(E)-(hydroxyimino)methyl]pyridin-1-ium
SMILES
O/N=C/c1ccc[n+](CC(NCc2ccccc2)=O)c1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
Cl-
Molecular Weight
270.31
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
1.809
Distribution Coefficient, logD
1.807
Water Solubility, LogSw
-1.96
Polar Surface Area
56.411
Acid Dissociation Constant (pKa)
9.96
Base Dissociation Constant (pKb)
-0.32
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
13.30
References: we are preparing a list of scientific research reports with 0134-0079 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)