C23H28N2O8S2
TL;DR: C23H28N2O8S2 (CAS 190774-61-9) is a chemical compound with molecular formula C23H28N2O8S2 and molecular weight 524.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S)-2-[(1S,2R,4R,6E,8Z,14R,18R)-1,14-dimethyl-5,16,21,21-tetraoxo-3-oxa-12,21λ6-dithia-15,22-diazatetracyclo[16.2.1.110,13.02,4]docosa-6,8,10,13(22)-tetraen-18-yl]-2-hydroxypropanoate
Also Known As: 3-Oxa-12,21-dithia-15,22-diazatetracyclo(16.2.1.110,13.02,4)docosa-6,8,10,13(22)-tetraene-18-acetic acid, alpha-hydroxy-alpha,1,14-trimethyl-5,16-dioxo-, methyl ester, 21,21-dioxide, (1S-(1R*,2S*,4S*,6E,8Z,14S*,18S*(R*)))-
| Molecular Formula | C23H28N2O8S2 |
|---|---|
| Molecular Weight | 524.13 g/mol |
| LogP | 1.26 |
| Topological Polar Surface Area | 152.26 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 2 |
| Exact Mass | 524.1287 |
| Heavy Atoms | 35 |
| Complexity | 1233.7407 |
Chemical Identifiers
| CAS Number | 190774-61-9 |
|---|---|
| SMILES | C[C@@H]1C2=NC(=CS2)/C=C\C=C\C(=O)[C@H]3[C@@H](O3)[C@@]4(CC[C@@](S4(=O)=O)(CC(=O)N1)[C@](C)(C(=O)OC)O)C |
Product Overview
C23H28N2O8S2 (CAS 190774-61-9), with molecular formula C23H28N2O8S2 and molecular weight 524.13 g/mol. IUPAC: methyl (2S)-2-[(1S,2R,4R,6E,8Z,14R,18R)-1,14-dimethyl-5,16,21,21-tetraoxo-3-oxa-12,21λ6-dithia-15,22-diazatetracyclo[16.2.1.110,13.02,4]docosa-6,8,10,13(22)-tetraen-18-yl]-2-hydroxypropanoate.
Chemical Property Profile of C23H28N2O8S2
Property Insights of C23H28N2O8S2
The XLogP value of 1.26 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C23H28N2O8S2. The TPSA of 152.26 Ų indicates high polarity, suggesting C23H28N2O8S2 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, C23H28N2O8S2 has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C23H28N2O8S2?
The CAS number of C23H28N2O8S2 is 190774-61-9.
What is the molecular formula of C23H28N2O8S2?
The molecular formula of C23H28N2O8S2 is C23H28N2O8S2.
What is the molecular weight of C23H28N2O8S2?
The molecular weight of C23H28N2O8S2 is 524.13 g/mol.
Where can I buy C23H28N2O8S2?
You can request a quote for C23H28N2O8S2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C23H28N2O8S2?
Yes, KEHONG BIO provides custom synthesis services for C23H28N2O8S2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.