Naflocort
TL;DR: Naflocort (CAS 80738-47-2) is a chemical compound with molecular formula C29H35FO5 and molecular weight 482.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-fluoro-12-hydroxy-15-(2-hydroxyacetyl)-10,14-dimethylhexacyclo[12.11.0.02,11.05,10.015,24.017,22]pentacosa-5,8,17,19,21-pentaen-7-one;hydrate
Also Known As: Naflocort, 4b-Fluoro-5-hydroxy-6b-(hydroxyacetyl)-4a,6a-dimethyl-4a,4b,5,6,6a,6b,7,12,12a,13,13a,13b,14,15-tetradecahydro-2H-benzo[5,6]indeno[2,1-a]phenanthren-2-one--water (1/1)
| Molecular Formula | C29H35FO5 |
|---|---|
| Molecular Weight | 482.25 g/mol |
| LogP | 3.11 |
| Topological Polar Surface Area | 75.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 482.24686 |
| Heavy Atoms | 35 |
| Complexity | 987.0 |
Chemical Identifiers
| CAS Number | 80738-47-2 |
|---|---|
| SMILES | CC12CC(C3(C(C1CC4C2(CC5=CC=CC=C5C4)C(=O)CO)CCC6=CC(=O)C=CC63C)F)O.O |
| InChIKey | XBGQGAPUUJJOTA-UHFFFAOYSA-N |
Product Overview
Naflocort (CAS 80738-47-2), with molecular formula C29H35FO5 and molecular weight 482.25 g/mol. IUPAC: 11-fluoro-12-hydroxy-15-(2-hydroxyacetyl)-10,14-dimethylhexacyclo[12.11.0.02,11.05,10.015,24.017,22]pentacosa-5,8,17,19,21-pentaen-7-one;hydrate.
Chemical Property Profile of Naflocort
Property Insights of Naflocort
The XLogP value of 3.11 indicates that Naflocort is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Naflocort. Following Lipinski's Rule of Five, Naflocort has 3 hydrogen bond donor(s) and 6 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 Naflocort?
The CAS number of Naflocort is 80738-47-2.
What is the molecular formula of Naflocort?
The molecular formula of Naflocort is C29H35FO5.
What is the molecular weight of Naflocort?
The molecular weight of Naflocort is 482.25 g/mol.
Where can I buy Naflocort?
You can request a quote for Naflocort directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Naflocort?
Yes, KEHONG BIO provides custom synthesis services for Naflocort and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.