Heliotrinium, N-(7-hydroxy-6,7-dihydro-5H-pyrrolizin-1-ylmethyl)-, chloride
TL;DR: Heliotrinium, N-(7-hydroxy-6,7-dihydro-5H-pyrrolizin-1-ylmethyl)-, chloride (CAS 24999-30-2) is a chemical compound with molecular formula C24H37ClN2O6 and molecular weight 484.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(7S)-7-hydroxy-4-[(7-hydroxy-6,7-dihydro-5H-pyrrolizin-1-yl)methyl]-5,6,7,8-tetrahydro-3H-pyrrolizin-4-ium-1-yl]methyl 2-hydroxy-2-(1-methoxyethyl)-3-methylbutanoate chloride
Also Known As: N-(7-Hydroxy-6,7-dihydro-5H-pyrrolizin-1-ylmethyl)heliotrinium chloride, HELIOTRINIUM, N-(7-HYDROXY-6,7-DIHYDRO-5H-PYRROLIZIN-1-YLMETHYL)-, CHLORIDE, (1S)-1-Hydroxy-4-[(1-hydroxy-2,3-dihydro-1H-pyrrolizin-7-yl)methyl]-7-({[2-hydroxy-2-(1-methoxyethyl)-3-methylbutanoyl]oxy}methyl)-2,3,5,7a-tetrahydro-1H-pyrrolizin-4-ium chloride, [(7S)-7-hydroxy-4-[(7-hydroxy-6,7-dihydro-5H-pyrrolizin-1-yl)methyl]-5,6,7,8-tetrahydro-3H-pyrrolizin-4-ium-1-yl]methyl 2-hydroxy-2-(1-methoxyethyl)-3-methylbutanoate chloride, 1-Hydroxy-4-[(1-hydroxy-2,3-dihydro-1H-pyrrolizin-7-yl)methyl]-7-({[2-hydroxy-2-(1-methoxyethyl)-3-methylbutanoyl]oxy}methyl)-2,3,5,7a-tetrahydro-1H-pyrrolizin-4-ium chloride
| Molecular Formula | C24H37ClN2O6 |
|---|---|
| Molecular Weight | 484.23 g/mol |
| LogP | -1.72 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 484.234 |
| Heavy Atoms | 33 |
| Complexity | 744.0 |
Chemical Identifiers
| CAS Number | 24999-30-2 |
|---|---|
| SMILES | CC(C)C(C(C)OC)(C(=O)OCC1=CC[N+]2(C1[C@H](CC2)O)CC3=C4C(CCN4C=C3)O)O.[Cl-] |
| InChIKey | DOYURYFHQKITAN-MJSHISICSA-M |
Product Overview
Heliotrinium, N-(7-hydroxy-6,7-dihydro-5H-pyrrolizin-1-ylmethyl)-, chloride (CAS 24999-30-2), with molecular formula C24H37ClN2O6 and molecular weight 484.23 g/mol. IUPAC: [(7S)-7-hydroxy-4-[(7-hydroxy-6,7-dihydro-5H-pyrrolizin-1-yl)methyl]-5,6,7,8-tetrahydro-3H-pyrrolizin-4-ium-1-yl]methyl 2-hydroxy-2-(1-methoxyethyl)-3-methylbutanoate chloride.
Chemical Property Profile of Heliotrinium, N-(7-hydroxy-6,7-dihydro-5H-pyrrolizin-1-ylmethyl)-, chloride
Property Insights of Heliotrinium, N-(7-hydroxy-6,7-dihydro-5H-pyrrolizin-1-ylmethyl)-, chloride
The XLogP value of -1.72 indicates that Heliotrinium, N-(7-hydroxy-6,7-dihydro-5H-pyrrolizin-1-ylmethyl)-, chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Heliotrinium, N-(7-hydroxy-6,7-dihydro-5H-pyrrolizin-1-ylmethyl)-, chloride. Following Lipinski's Rule of Five, Heliotrinium, N-(7-hydroxy-6,7-dihydro-5H-pyrrolizin-1-ylmethyl)-, chloride has 3 hydrogen bond donor(s) and 7 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 Heliotrinium, N-(7-hydroxy-6,7-dihydro-5H-pyrrolizin-1-ylmethyl)-, chloride?
The CAS number of Heliotrinium, N-(7-hydroxy-6,7-dihydro-5H-pyrrolizin-1-ylmethyl)-, chloride is 24999-30-2.
What is the molecular formula of Heliotrinium, N-(7-hydroxy-6,7-dihydro-5H-pyrrolizin-1-ylmethyl)-, chloride?
The molecular formula of Heliotrinium, N-(7-hydroxy-6,7-dihydro-5H-pyrrolizin-1-ylmethyl)-, chloride is C24H37ClN2O6.
What is the molecular weight of Heliotrinium, N-(7-hydroxy-6,7-dihydro-5H-pyrrolizin-1-ylmethyl)-, chloride?
The molecular weight of Heliotrinium, N-(7-hydroxy-6,7-dihydro-5H-pyrrolizin-1-ylmethyl)-, chloride is 484.23 g/mol.
Where can I buy Heliotrinium, N-(7-hydroxy-6,7-dihydro-5H-pyrrolizin-1-ylmethyl)-, chloride?
You can request a quote for Heliotrinium, N-(7-hydroxy-6,7-dihydro-5H-pyrrolizin-1-ylmethyl)-, chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Heliotrinium, N-(7-hydroxy-6,7-dihydro-5H-pyrrolizin-1-ylmethyl)-, chloride?
Yes, KEHONG BIO provides custom synthesis services for Heliotrinium, N-(7-hydroxy-6,7-dihydro-5H-pyrrolizin-1-ylmethyl)-, chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.