Norcholestenol iodomethyl ((sup 131)I)
TL;DR: Norcholestenol iodomethyl ((sup 131)I) (CAS 56897-09-7) is a chemical compound with molecular formula C27H45IO and molecular weight 516.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,6R,8S,9S,13R,14S,17R)-6-((131I)iodomethyl)-13-methyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-ol
Also Known As: Adosterol (TN), Adosterol-131I, ADOSTEROL, Iodine (131I) norcholesterol, norcholestenol iodomethyl i-131
| Molecular Formula | C27H45IO |
|---|---|
| Molecular Weight | 516.25 g/mol |
| LogP | 8.8 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 516.2532 |
| Heavy Atoms | 29 |
| Complexity | 610.0 |
Chemical Identifiers
| CAS Number | 56897-09-7 |
|---|---|
| SMILES | C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@H](C4=C3CC[C@@H](C4)O)C[131I])C |
| InChIKey | QJHZPCLORSPENH-DRTKWHMQSA-N |
Product Overview
Norcholestenol iodomethyl ((sup 131)I) (CAS 56897-09-7), with molecular formula C27H45IO and molecular weight 516.25 g/mol. IUPAC: (3S,6R,8S,9S,13R,14S,17R)-6-((131I)iodomethyl)-13-methyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-ol.
Chemical Property Profile of Norcholestenol iodomethyl ((sup 131)I)
Property Insights of Norcholestenol iodomethyl ((sup 131)I)
The XLogP value of 8.8 indicates that Norcholestenol iodomethyl ((sup 131)I) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, Norcholestenol iodomethyl ((sup 131)I) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Norcholestenol iodomethyl ((sup 131)I) has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Norcholestenol iodomethyl ((sup 131)I)?
The CAS number of Norcholestenol iodomethyl ((sup 131)I) is 56897-09-7.
What is the molecular formula of Norcholestenol iodomethyl ((sup 131)I)?
The molecular formula of Norcholestenol iodomethyl ((sup 131)I) is C27H45IO.
What is the molecular weight of Norcholestenol iodomethyl ((sup 131)I)?
The molecular weight of Norcholestenol iodomethyl ((sup 131)I) is 516.25 g/mol.
Where can I buy Norcholestenol iodomethyl ((sup 131)I)?
You can request a quote for Norcholestenol iodomethyl ((sup 131)I) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Norcholestenol iodomethyl ((sup 131)I)?
Yes, KEHONG BIO provides custom synthesis services for Norcholestenol iodomethyl ((sup 131)I) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.