Rosellichalasin
TL;DR: Rosellichalasin (CAS 123452-64-2) is a chemical compound with molecular formula C28H33NO5 and molecular weight 463.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z,10E)-18-benzyl-6,8,15,16-tetramethyl-2,14-dioxa-19-azatetracyclo[10.8.0.01,17.013,15]icosa-5,10-diene-3,7,20-trione
Also Known As: Rosellichalasin, (5Z,10E)-18-benzyl-6,8,15,16-tetramethyl-2,14-dioxa-19-azatetracyclo[10.8.0.01,17.013,15]icosa-5,10-diene-3,7,20-trione, (5Z,10E)-18-benzyl-6,8,15,16-tetramethyl-2,14-dioxa-19-azatetracyclo(10.8.0.01,17.013,15)icosa-5,10-diene-3,7,20-trione, 3H-Oxacyclododecino(2,3-d)oxireno(f)isoindole-5,9,11(4H,8H,12H)-trione, 13,13a,14,14a,15a,15b-hexahydro-4,6,14,14a-tetramethyl-13-(phenylmethyl)-, (4S-(1E,4R*,6E,10aR*,13R*,13aR*,14R*,14aS*,15aR*,15bR*))-, 3H-Oxacyclododecino(2,3-d)oxireno(f)isoindole-5,9,11(4H,8H,12H)-trione, 13,13a,14,14a,15a,15b-hexahydro-4,6,14,14a-tetramethyl-13-(phenylmethyl)-, (4S-(1E,4R*,6E,10aR*,13R*,13aR*,14R*,14aS*,15aR*,15bR*))-
| Molecular Formula | C28H33NO5 |
|---|---|
| Molecular Weight | 463.24 g/mol |
| LogP | 3.5506 |
| Topological Polar Surface Area | 85.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 463.23587 |
| Heavy Atoms | 34 |
| Complexity | 1077.5272 |
Chemical Identifiers
| CAS Number | 123452-64-2 |
|---|---|
| SMILES | CC1C/C=C/C2C3C(O3)(C(C4C2(C(=O)NC4CC5=CC=CC=C5)OC(=O)C/C=C(\C1=O)/C)C)C |
Product Overview
Rosellichalasin (CAS 123452-64-2), with molecular formula C28H33NO5 and molecular weight 463.24 g/mol. IUPAC: (5Z,10E)-18-benzyl-6,8,15,16-tetramethyl-2,14-dioxa-19-azatetracyclo[10.8.0.01,17.013,15]icosa-5,10-diene-3,7,20-trione.
Chemical Property Profile of Rosellichalasin
Property Insights of Rosellichalasin
The XLogP value of 3.5506 indicates that Rosellichalasin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Rosellichalasin. Following Lipinski's Rule of Five, Rosellichalasin has 1 hydrogen bond donor(s) and 5 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 Rosellichalasin?
The CAS number of Rosellichalasin is 123452-64-2.
What is the molecular formula of Rosellichalasin?
The molecular formula of Rosellichalasin is C28H33NO5.
What is the molecular weight of Rosellichalasin?
The molecular weight of Rosellichalasin is 463.24 g/mol.
Where can I buy Rosellichalasin?
You can request a quote for Rosellichalasin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Rosellichalasin?
Yes, KEHONG BIO provides custom synthesis services for Rosellichalasin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.