Y500-1848 Screening compound: N-(2-adamantyl)-1-methyl-4-nitro-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of ChemDiv screening compound Y500-1848
N-(2-adamantyl)-1-methyl-4-nitro-1H-pyrazole-3-carboxamide
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
Y500-1848
Molecular Formula
C15H20N4O3 (C15 H20 N4 O3)
Compound Name
N-(2-adamantyl)-1-methyl-4-nitro-1H-pyrazole-3-carboxamide
IUPAC name
N-(adamantan-2-yl)-1-methyl-4-nitro-1H-pyrazole-3-carboxamide
SMILES
Cn1nc(C(NC2C3CC(C4)CC2CC4C3)=O)c([N+]([O-])=O)c1
InChI Key
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
304.35
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
2.214
Distribution Coefficient, logD
2.214
Water Solubility, LogSw
-2.36
Polar Surface Area
73.435
Acid Dissociation Constant (pKa)
12.67
Base Dissociation Constant (pKb)
-2.75
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
73.33
References: we are preparing a list of scientific research reports with Y500-1848 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)