Petromindole
TL;DR: Petromindole (CAS 198992-51-7) is a chemical compound with molecular formula C28H39NO and molecular weight 405.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,5R,6S,9R,11S,14S,15R)-2,6,10,10,14-pentamethyl-19-azahexacyclo[15.6.1.02,15.05,14.06,11.020,24]tetracosa-1(24),17,20,22-tetraen-9-ol
Also Known As: Petromindole, (2R,4aS,4bR,6aR,12aR,12bS,14aS)-1,1,4a,6a,12b-Pentamethyl-1,2,3,4,4a,4b,5,6,6a,10,12,12a,12b,13,14,14a-hexadecahydrochryseno(3,2,1-cd)indol-2-ol, (2R,5R,6S,9R,11S,14S,15R)-2,6,10,10,14-pentamethyl-19-azahexacyclo[15.6.1.02,15.05,14.06,11.020,24]tetracosa-1(24),17,20,22-tetraen-9-ol, (17S)-18,22,22-Trimethyl-4,6-(epiminometheno)-23,24,27,28,29,30-hexanorfriedela-1,3,5(10)-trien-21beta-ol, (2R,4aS,4bR,6aR,12aR,12bS,14aS)-1,1,4a,6a,12b-pentamethyl-1,2,3,4,4a,4b,5,6,6a,10,12,12a,12b,13,14,14a-hexadecahydrochryseno[3,2,1-cd]indol-2-ol
| Molecular Formula | C28H39NO |
|---|---|
| Molecular Weight | 405.30 g/mol |
| LogP | 7.5 |
| Topological Polar Surface Area | 36.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 405.30316 |
| Heavy Atoms | 30 |
| Complexity | 717.0 |
Chemical Identifiers
| CAS Number | 198992-51-7 |
|---|---|
| SMILES | C[C@@]12CC[C@H](C([C@H]1CC[C@]3([C@H]2CC[C@@]4([C@@H]3CC5=CNC6=CC=CC4=C56)C)C)(C)C)O |
| InChIKey | DRNNQNUPQAJBQZ-DIADYQGESA-N |
Product Overview
Petromindole (CAS 198992-51-7), with molecular formula C28H39NO and molecular weight 405.30 g/mol. IUPAC: (2R,5R,6S,9R,11S,14S,15R)-2,6,10,10,14-pentamethyl-19-azahexacyclo[15.6.1.02,15.05,14.06,11.020,24]tetracosa-1(24),17,20,22-tetraen-9-ol.
Chemical Property Profile of Petromindole
Property Insights of Petromindole
The XLogP value of 7.5 indicates that Petromindole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.0 Ų, Petromindole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Petromindole has 2 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 Petromindole?
The CAS number of Petromindole is 198992-51-7.
What is the molecular formula of Petromindole?
The molecular formula of Petromindole is C28H39NO.
What is the molecular weight of Petromindole?
The molecular weight of Petromindole is 405.30 g/mol.
Where can I buy Petromindole?
You can request a quote for Petromindole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Petromindole?
Yes, KEHONG BIO provides custom synthesis services for Petromindole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.