Histargin
TL;DR: Histargin (CAS 93361-69-4) is a chemical compound with molecular formula C14H25N7O4 and molecular weight 355.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[2-[[(1S)-1-carboxy-2-(1H-imidazol-5-yl)ethyl]amino]ethylamino]-5-(diaminomethylideneamino)pentanoic acid
Also Known As: Histargin, (2S)-2-[2-[[(1S)-1-carboxy-2-(1H-imidazol-5-yl)ethyl]amino]ethylamino]-5-(diaminomethylideneamino)pentanoic acid, (S)-N-(2-((4-((Aminoiminomethyl)amino)-1-carboxybutyl)amino)ethyl)-L-histidine, 7,9-dihydro-6H-pyrimido[5,4-b][1,4]oxazepin-8-one, L-Histidine, N-(2-((4-((aminoiminomethyl)amino)-1-carboxybutyl)amino)ethyl)-, (S)-
| Molecular Formula | C14H25N7O4 |
|---|---|
| Molecular Weight | 355.20 g/mol |
| LogP | -6.6 |
| Topological Polar Surface Area | 192.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 13 |
| Exact Mass | 355.1968 |
| Heavy Atoms | 25 |
| Complexity | 456.0 |
Chemical Identifiers
| CAS Number | 93361-69-4 |
|---|---|
| SMILES | C1=C(NC=N1)C[C@@H](C(=O)O)NCCN[C@@H](CCCN=C(N)N)C(=O)O |
| InChIKey | LLPMPMKLOHAIMY-QWRGUYRKSA-N |
Product Overview
Histargin (CAS 93361-69-4), with molecular formula C14H25N7O4 and molecular weight 355.20 g/mol. IUPAC: (2S)-2-[2-[[(1S)-1-carboxy-2-(1H-imidazol-5-yl)ethyl]amino]ethylamino]-5-(diaminomethylideneamino)pentanoic acid.
Chemical Property Profile of Histargin
Property Insights of Histargin
The XLogP value of -6.6 indicates that Histargin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 192.0 Ų indicates high polarity, suggesting Histargin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Histargin has 7 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Histargin?
The CAS number of Histargin is 93361-69-4.
What is the molecular formula of Histargin?
The molecular formula of Histargin is C14H25N7O4.
What is the molecular weight of Histargin?
The molecular weight of Histargin is 355.20 g/mol.
Where can I buy Histargin?
You can request a quote for Histargin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Histargin?
Yes, KEHONG BIO provides custom synthesis services for Histargin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.