![Methyl N~5~-[N-(4-methylbenzene-1-sulfonyl)carbamimidoyl]ornithinate structure](/static/products/9014/901-47-3.webp)
Methyl N~5~-[N-(4-methylbenzene-1-sulfonyl)carbamimidoyl]ornithinate
TL;DR: Methyl N~5~-[N-(4-methylbenzene-1-sulfonyl)carbamimidoyl]ornithinate (CAS 901-47-3) is a chemical compound with molecular formula C14H22N4O4S and molecular weight 342.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-amino-5-[[amino-[(4-methylphenyl)sulfonylamino]methylidene]amino]pentanoate
Also Known As: Tame, TOSYLARGININE METHYL ESTER, Methyl N~5~-[N-(4-methylbenzene-1-sulfonyl)carbamimidoyl]ornithinate, methyl (E)-2-amino-5-((amino((4-methylphenyl)sulfonamido)methylene)amino)pentanoate, methyl 2-amino-5-[[amino-[(4-methylphenyl)sulfonylamino]methylidene]amino]pentanoate
| Molecular Formula | C14H22N4O4S |
|---|---|
| Molecular Weight | 342.14 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 145.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 342.13617 |
| Heavy Atoms | 23 |
| Complexity | 507.0 |
Chemical Identifiers
| CAS Number | 901-47-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC(=NCCCC(C(=O)OC)N)N |
| InChIKey | GIGVCLWIEMFWBF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl N~5~-[N-(4-methylbenzene-1-sulfonyl)carbamimidoyl]ornithinate (CAS 901-47-3), with molecular formula C14H22N4O4S and molecular weight 342.14 g/mol. IUPAC: methyl 2-amino-5-[[amino-[(4-methylphenyl)sulfonylamino]methylidene]amino]pentanoate.
Chemical Property Profile of Methyl N~5~-[N-(4-methylbenzene-1-sulfonyl)carbamimidoyl]ornithinate
Property Insights of Methyl N~5~-[N-(4-methylbenzene-1-sulfonyl)carbamimidoyl]ornithinate
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl N~5~-[N-(4-methylbenzene-1-sulfonyl)carbamimidoyl]ornithinate. The TPSA of 145.0 Ų indicates high polarity, suggesting Methyl N~5~-[N-(4-methylbenzene-1-sulfonyl)carbamimidoyl]ornithinate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Methyl N~5~-[N-(4-methylbenzene-1-sulfonyl)carbamimidoyl]ornithinate has 3 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 Methyl N~5~-[N-(4-methylbenzene-1-sulfonyl)carbamimidoyl]ornithinate?
The CAS number of Methyl N~5~-[N-(4-methylbenzene-1-sulfonyl)carbamimidoyl]ornithinate is 901-47-3.
What is the molecular formula of Methyl N~5~-[N-(4-methylbenzene-1-sulfonyl)carbamimidoyl]ornithinate?
The molecular formula of Methyl N~5~-[N-(4-methylbenzene-1-sulfonyl)carbamimidoyl]ornithinate is C14H22N4O4S.
What is the molecular weight of Methyl N~5~-[N-(4-methylbenzene-1-sulfonyl)carbamimidoyl]ornithinate?
The molecular weight of Methyl N~5~-[N-(4-methylbenzene-1-sulfonyl)carbamimidoyl]ornithinate is 342.14 g/mol.
Where can I buy Methyl N~5~-[N-(4-methylbenzene-1-sulfonyl)carbamimidoyl]ornithinate?
You can request a quote for Methyl N~5~-[N-(4-methylbenzene-1-sulfonyl)carbamimidoyl]ornithinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl N~5~-[N-(4-methylbenzene-1-sulfonyl)carbamimidoyl]ornithinate?
Yes, KEHONG BIO provides custom synthesis services for Methyl N~5~-[N-(4-methylbenzene-1-sulfonyl)carbamimidoyl]ornithinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.