Y509-0402 Screening compound: N~1~-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-N~1~-methyl-3-nitrobenzamide
Chemical Structure Depiction of ChemDiv screening compound Y509-0402
N~1~-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-N~1~-methyl-3-nitrobenzamide
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
Y509-0402
Molecular Formula
C14H16N4O3 (C14 H16 N4 O3)
Compound Name
N~1~-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-N~1~-methyl-3-nitrobenzamide
IUPAC name
n/a
SMILES
Cc1nn(C)cc1CN(C)C(c1cccc([N+]([O-])=O)c1)=O
InChI
InChI Key
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
288.31
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
0.983
Distribution Coefficient, logD
0.983
Water Solubility, LogSw
-1.97
Polar Surface Area
64.932
Acid Dissociation Constant (pKa)
23.74
Base Dissociation Constant (pKb)
0.40
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
28.60
References: we are preparing a list of scientific research reports with Y509-0402 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)