Napyradiomycin B4
TL;DR: Napyradiomycin B4 (CAS 123958-40-7) is a chemical compound with molecular formula C25H31Cl3O6 and molecular weight 532.11865 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3R,4aR,10aS)-3,4a-dichloro-10a-[[(1S,3S,6S)-3-chloro-6-hydroxy-2,2,6-trimethylcyclohexyl]methyl]-6,8-dihydroxy-2,2-dimethyl-3,4-dihydrobenzo[g]chromene-5,10-dione
Also Known As: Napyradiomycin B4, Npd-B4, 13-Hydroxy-13-methylnapyradiomycin B1, KST-1A0928, HY-N12740
Technical Specifications
| Molecular Formula | C25H31Cl3O6 |
| Molecular Weight | 532.11865 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 532.11865 Da |
| Heavy Atoms | 34 |
| Complexity | 879.0 |
| SMILES | C[C@@]1(CC[C@@H](C([C@@H]1C[C@]23C(=O)C4=C(C(=CC(=C4)O)O)C(=O)[C@]2(C[C@H](C(O3)(C)C)Cl)Cl)(C)C)Cl)O |
| InChIKey | WIMMWIAJQXLZLL-VTQDYBALSA-N |
Chemical Property Profile of Napyradiomycin B4
Property Insights of Napyradiomycin B4
The XLogP value of 5.2 indicates that Napyradiomycin B4 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Napyradiomycin B4. Following Lipinski's Rule of Five, Napyradiomycin B4 has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Napyradiomycin B4?
The CAS number of Napyradiomycin B4 is 123958-40-7.
What is the molecular formula of Napyradiomycin B4?
The molecular formula of Napyradiomycin B4 is C25H31Cl3O6.
What is the molecular weight of Napyradiomycin B4?
The molecular weight of Napyradiomycin B4 is 532.11865 g/mol.
Where can I buy Napyradiomycin B4?
You can request a quote for Napyradiomycin B4 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Napyradiomycin B4?
Yes, CoreyChem provides custom synthesis services for Napyradiomycin B4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.