RefChem:1090886
TL;DR: RefChem:1090886 (CAS 36371-23-0) is a chemical compound with molecular formula C17H29N5O5 and molecular weight 383.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,6-dimethylphenyl)-1,4-diethylpiperazine-2-carboxamide;nitrous acid
Also Known As: 1,4-Diethyl-2',6'-dimethyl-2-piperazinecarboxanilide dinitrate, 2-Piperazinecarboxanilide, 1,4-diethyl-2',6'-dimethyl-, dinitrate, N-(2,6-Dimethylphenyl)-1,4-diethylpiperazine-2-carboximidic acid--nitrous acid (1/2), 2-Piperazinecarboxamide, N-(2,6-dimethylphenyl)-1,4-diethyl-, dinitrate, N-(2,6-dimethylphenyl)-1,4-diethylpiperazine-2-carboxamide; nitrous acid
| Molecular Formula | C17H29N5O5 |
|---|---|
| Molecular Weight | 383.22 g/mol |
| LogP | 2.55 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 383.21686 |
| Heavy Atoms | 27 |
| Complexity | 347.0 |
Chemical Identifiers
| CAS Number | 36371-23-0 |
|---|---|
| SMILES | CCN1CCN(C(C1)C(=O)NC2=C(C=CC=C2C)C)CC.N(=O)O.N(=O)O |
| InChIKey | OMTSAXNHNKXZKC-UHFFFAOYSA-N |
Product Overview
RefChem:1090886 (CAS 36371-23-0), with molecular formula C17H29N5O5 and molecular weight 383.22 g/mol. IUPAC: N-(2,6-dimethylphenyl)-1,4-diethylpiperazine-2-carboxamide;nitrous acid.
Chemical Property Profile of RefChem:1090886
Property Insights of RefChem:1090886
The XLogP value of 2.55 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1090886. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1090886. Following Lipinski's Rule of Five, RefChem:1090886 has 3 hydrogen bond donor(s) and 9 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 RefChem:1090886?
The CAS number of RefChem:1090886 is 36371-23-0.
What is the molecular formula of RefChem:1090886?
The molecular formula of RefChem:1090886 is C17H29N5O5.
What is the molecular weight of RefChem:1090886?
The molecular weight of RefChem:1090886 is 383.22 g/mol.
Where can I buy RefChem:1090886?
You can request a quote for RefChem:1090886 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1090886?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1090886 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.