Pyrinodemin C
TL;DR: Pyrinodemin C (CAS 292041-82-8) is a chemical compound with molecular formula C37H57N3O and molecular weight 559.45 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,3aS,6aR)-3-(8-pyridin-3-yloctyl)-1-[(Z)-13-pyridin-3-yltridec-4-enyl]-3,3a,4,5,6,6a-hexahydrocyclopenta[c][1,2]oxazole
Also Known As: Pyrinodemin C, pyrinodemin-C, J1.309.319I, (3S)-1-[(4Z)-13-(3-Pyridyl)-4-tridecenyl]-3beta-[8-(3-pyridyl)octyl]-3,3aalpha,4,5,6,6aalpha-hexahydro-1H-cyclopenta[c]isoxazole, (3S)-1-[(Z)-13-(3-Pyridyl)-4-tridecenyl]-3beta-[8-(3-pyridyl)octyl]-3,3aalpha,4,5,6,6aalpha-hexahydro-1H-cyclopenta[c]isoxazole
| Molecular Formula | C37H57N3O |
|---|---|
| Molecular Weight | 559.45 g/mol |
| LogP | 9.8441 |
| Topological Polar Surface Area | 38.25 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 22 |
| Exact Mass | 559.45013 |
| Heavy Atoms | 41 |
| Complexity | 933.7242 |
Chemical Identifiers
| CAS Number | 292041-82-8 |
|---|---|
| SMILES | C1C[C@H]2[C@@H](C1)N(O[C@H]2CCCCCCCCC3=CN=CC=C3)CCC/C=C\CCCCCCCCC4=CN=CC=C4 |
Product Overview
Pyrinodemin C (CAS 292041-82-8), with molecular formula C37H57N3O and molecular weight 559.45 g/mol. IUPAC: (3S,3aS,6aR)-3-(8-pyridin-3-yloctyl)-1-[(Z)-13-pyridin-3-yltridec-4-enyl]-3,3a,4,5,6,6a-hexahydrocyclopenta[c][1,2]oxazole.
Chemical Property Profile of Pyrinodemin C
Property Insights of Pyrinodemin C
The XLogP value of 9.8441 indicates that Pyrinodemin C is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.25 Ų, Pyrinodemin C exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrinodemin C has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pyrinodemin C?
The CAS number of Pyrinodemin C is 292041-82-8.
What is the molecular formula of Pyrinodemin C?
The molecular formula of Pyrinodemin C is C37H57N3O.
What is the molecular weight of Pyrinodemin C?
The molecular weight of Pyrinodemin C is 559.45 g/mol.
Where can I buy Pyrinodemin C?
You can request a quote for Pyrinodemin C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrinodemin C?
Yes, KEHONG BIO provides custom synthesis services for Pyrinodemin C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.