Aldol-histidine
TL;DR: Aldol-histidine (CAS 38964-85-1) is a chemical compound with molecular formula C18H31N5O6 and molecular weight 413.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,10-diamino-6-[2-amino-3-(1H-imidazol-5-yl)propanoyl]-5-(hydroxymethyl)undecanedioic acid
Also Known As: Aldol-histidine, 2,10-Diamino-5-hydroxymethyl-6-(N-1-histidyl) undecandioic acid, 2,10-diamino-6-[2-amino-3-(1H-imidazol-5-yl)propanoyl]-5-(hydroxymethyl)undecanedioic acid, Undecanedioic acid, 2,10-diamino-6-(4-(2-amino-2-carboxyethyl)-1H-imidazol-1-yl)-5-(hydroxymethyl)-, 2,10-diamino-6-[2-amino-3-(3H-imidazol-4-yl)propanoyl]-5-(hydroxymethyl)undecanedioic acid
| Molecular Formula | C18H31N5O6 |
|---|---|
| Molecular Weight | 413.23 g/mol |
| LogP | -1.1524 |
| Topological Polar Surface Area | 218.64 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 15 |
| Exact Mass | 413.22745 |
| Heavy Atoms | 29 |
| Complexity | 653.1767 |
Chemical Identifiers
| CAS Number | 38964-85-1 |
|---|---|
| SMILES | C1=C(NC=N1)CC(C(=O)C(CCCC(C(=O)O)N)C(CCC(C(=O)O)N)CO)N |
Product Overview
Aldol-histidine (CAS 38964-85-1), with molecular formula C18H31N5O6 and molecular weight 413.23 g/mol. IUPAC: 2,10-diamino-6-[2-amino-3-(1H-imidazol-5-yl)propanoyl]-5-(hydroxymethyl)undecanedioic acid.
Chemical Property Profile of Aldol-histidine
Property Insights of Aldol-histidine
The XLogP value of -1.1524 indicates that Aldol-histidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 218.64 Ų indicates high polarity, suggesting Aldol-histidine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Aldol-histidine 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 Aldol-histidine?
The CAS number of Aldol-histidine is 38964-85-1.
What is the molecular formula of Aldol-histidine?
The molecular formula of Aldol-histidine is C18H31N5O6.
What is the molecular weight of Aldol-histidine?
The molecular weight of Aldol-histidine is 413.23 g/mol.
Where can I buy Aldol-histidine?
You can request a quote for Aldol-histidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aldol-histidine?
Yes, KEHONG BIO provides custom synthesis services for Aldol-histidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.