6-[(~123~I)Iodomethyl]-19-norcholest-5(10)-en-3-ol
TL;DR: 6-[(~123~I)Iodomethyl]-19-norcholest-5(10)-en-3-ol (CAS 68232-36-0) is a chemical compound with molecular formula C27H45IO and molecular weight 508.25 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-((123I)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: Bimetrol, I-Bimetrol, ADOSTEROL, 6-iodomethylcholesterol, 6beta-Iodomethyl-19-norcholesterol
| Molecular Formula | C27H45IO |
|---|---|
| Molecular Weight | 508.25 g/mol |
| LogP | 7.8038 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 508.25262 |
| Heavy Atoms | 29 |
| Complexity | 609.65906 |
Chemical Identifiers
| CAS Number | 68232-36-0 |
|---|---|
| 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[123I])C |
Product Overview
6-[(~123~I)Iodomethyl]-19-norcholest-5(10)-en-3-ol (CAS 68232-36-0), with molecular formula C27H45IO and molecular weight 508.25 g/mol. IUPAC: (3S,6R,8S,9S,13R,14S,17R)-6-((123I)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 6-[(~123~I)Iodomethyl]-19-norcholest-5(10)-en-3-ol
Property Insights of 6-[(~123~I)Iodomethyl]-19-norcholest-5(10)-en-3-ol
The XLogP value of 7.8038 indicates that 6-[(~123~I)Iodomethyl]-19-norcholest-5(10)-en-3-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.23 Ų, 6-[(~123~I)Iodomethyl]-19-norcholest-5(10)-en-3-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-[(~123~I)Iodomethyl]-19-norcholest-5(10)-en-3-ol 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 6-[(~123~I)Iodomethyl]-19-norcholest-5(10)-en-3-ol?
The CAS number of 6-[(~123~I)Iodomethyl]-19-norcholest-5(10)-en-3-ol is 68232-36-0.
What is the molecular formula of 6-[(~123~I)Iodomethyl]-19-norcholest-5(10)-en-3-ol?
The molecular formula of 6-[(~123~I)Iodomethyl]-19-norcholest-5(10)-en-3-ol is C27H45IO.
What is the molecular weight of 6-[(~123~I)Iodomethyl]-19-norcholest-5(10)-en-3-ol?
The molecular weight of 6-[(~123~I)Iodomethyl]-19-norcholest-5(10)-en-3-ol is 508.25 g/mol.
Where can I buy 6-[(~123~I)Iodomethyl]-19-norcholest-5(10)-en-3-ol?
You can request a quote for 6-[(~123~I)Iodomethyl]-19-norcholest-5(10)-en-3-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-[(~123~I)Iodomethyl]-19-norcholest-5(10)-en-3-ol?
Yes, KEHONG BIO provides custom synthesis services for 6-[(~123~I)Iodomethyl]-19-norcholest-5(10)-en-3-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.