N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-nitro-1H-pyrazole-5-carboxamide
TL;DR: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-nitro-1H-pyrazole-5-carboxamide (CAS 1005585-08-9) is a chemical compound with molecular formula C17H19N5O3S and molecular weight 373.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-nitro-1H-pyrazole-5-carboxamide
Also Known As: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-nitro-1H-pyrazole-5-carboxamide, N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-nitro-2H-pyrazole-3-carboxamide, N-[4-(1-ADAMANTYL)-1,3-THIAZOL-2-YL]-4-NITRO-1H-PYRAZOLE-3-CARBOXAMIDE, 4-nitro-N-[4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,3-thiazol-2-yl]-1H-pyrazole-3-carboxamide
| Molecular Formula | C17H19N5O3S |
|---|---|
| Molecular Weight | 373.12 g/mol |
| LogP | 3.4945 |
| Topological Polar Surface Area | 113.81 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 373.12085 |
| Heavy Atoms | 26 |
| Complexity | 853.3161 |
Chemical Identifiers
| CAS Number | 1005585-08-9 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)C4=CSC(=N4)NC(=O)C5=C(C=NN5)[N+](=O)[O-] |
Product Overview
N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-nitro-1H-pyrazole-5-carboxamide (CAS 1005585-08-9), with molecular formula C17H19N5O3S and molecular weight 373.12 g/mol. IUPAC: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-nitro-1H-pyrazole-5-carboxamide.
Chemical Property Profile of N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-nitro-1H-pyrazole-5-carboxamide
Property Insights of N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-nitro-1H-pyrazole-5-carboxamide
The XLogP value of 3.4945 indicates that N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-nitro-1H-pyrazole-5-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.81 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-nitro-1H-pyrazole-5-carboxamide. Following Lipinski's Rule of Five, N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-nitro-1H-pyrazole-5-carboxamide has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-nitro-1H-pyrazole-5-carboxamide?
The CAS number of N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-nitro-1H-pyrazole-5-carboxamide is 1005585-08-9.
What is the molecular formula of N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-nitro-1H-pyrazole-5-carboxamide?
The molecular formula of N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-nitro-1H-pyrazole-5-carboxamide is C17H19N5O3S.
What is the molecular weight of N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-nitro-1H-pyrazole-5-carboxamide?
The molecular weight of N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-nitro-1H-pyrazole-5-carboxamide is 373.12 g/mol.
Where can I buy N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-nitro-1H-pyrazole-5-carboxamide?
You can request a quote for N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-nitro-1H-pyrazole-5-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-nitro-1H-pyrazole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-nitro-1H-pyrazole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.