5-(N-甲基-N-异丁基)阿米洛利
TL;DR: 5-(N-甲基-N-异丁基)阿米洛利 (CAS 96861-65-3) is a chemical compound with molecular formula C11H18ClN7O and molecular weight 299.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(N-甲基-N-异丁基)阿米洛利
3-amino-5-[tert-butyl(methyl)amino]-6-chloro-N-(diaminomethylidene)pyrazine-2-carboxamide
Also Known As: 5-(N-Methyl-N-isobutyl)amiloride, 5-(N-methyl-N-isobutyl)-Amiloride, MIA, 3-amino-5-[tert-butyl(methyl)amino]-6-chloro-N-(diaminomethylidene)pyrazine-2-carboxamide, 3-amino-5-[tert-butyl(methyl)amino]-N-carbamimidoyl-6-chloropyrazine-2-carboxamide
| Molecular Formula | C11H18ClN7O |
|---|---|
| Molecular Weight | 299.13 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 137.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 299.12613 |
| Heavy Atoms | 20 |
| Complexity | 391.0 |
Chemical Identifiers
| CAS Number | 96861-65-3 |
|---|---|
| SMILES | CC(C)(C)N(C)C1=NC(=C(N=C1Cl)C(=O)N=C(N)N)N |
| InChIKey | YVFSEWDHZYWBNR-UHFFFAOYSA-N |
Product Overview
5-(N-甲基-N-异丁基)阿米洛利 (CAS 96861-65-3), with molecular formula C11H18ClN7O and molecular weight 299.13 g/mol. IUPAC: 3-amino-5-[tert-butyl(methyl)amino]-6-chloro-N-(diaminomethylidene)pyrazine-2-carboxamide.
Chemical Property Profile of 5-(N-甲基-N-异丁基)阿米洛利
Property Insights of 5-(N-甲基-N-异丁基)阿米洛利
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(N-甲基-N-异丁基)阿米洛利. The TPSA of 137.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(N-甲基-N-异丁基)阿米洛利. Following Lipinski's Rule of Five, 5-(N-甲基-N-异丁基)阿米洛利 has 3 hydrogen bond donor(s) and 5 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 5-(N-甲基-N-异丁基)阿米洛利?
The CAS number of 5-(N-甲基-N-异丁基)阿米洛利 is 96861-65-3.
What is the molecular formula of 5-(N-甲基-N-异丁基)阿米洛利?
The molecular formula of 5-(N-甲基-N-异丁基)阿米洛利 is C11H18ClN7O.
What is the molecular weight of 5-(N-甲基-N-异丁基)阿米洛利?
The molecular weight of 5-(N-甲基-N-异丁基)阿米洛利 is 299.13 g/mol.
Where can I buy 5-(N-甲基-N-异丁基)阿米洛利?
You can request a quote for 5-(N-甲基-N-异丁基)阿米洛利 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(N-甲基-N-异丁基)阿米洛利?
Yes, KEHONG BIO provides custom synthesis services for 5-(N-甲基-N-异丁基)阿米洛利 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.