C23H28N2O6S2
TL;DR: C23H28N2O6S2 (CAS 190774-59-5) is a chemical compound with molecular formula C23H28N2O6S2 and molecular weight 492.14 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-dioxo-3-oxa-12,21-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, (1S-(1R*,2S*,4S*,6E,8Z,14S*,18S*(R*)))-
| Molecular Formula | C23H28N2O6S2 |
|---|---|
| Molecular Weight | 492.14 g/mol |
| LogP | 2.5784 |
| Topological Polar Surface Area | 118.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 492.1389 |
| Heavy Atoms | 33 |
| Complexity | 1033.8967 |
Chemical Identifiers
| CAS Number | 190774-59-5 |
|---|---|
| SMILES | C[C@@H]1C2=NC(=CS2)/C=C\C=C\C(=O)[C@H]3[C@@H](O3)[C@@]4(CC[C@@](S4)(CC(=O)N1)[C@](C)(C(=O)OC)O)C |
Product Overview
C23H28N2O6S2 (CAS 190774-59-5), with molecular formula C23H28N2O6S2 and molecular weight 492.14 g/mol. IUPAC: methyl (2S)-2-[(1S,2R,4R,6E,8Z,14R,18R)-1,14-dimethyl-5,16-dioxo-3-oxa-12,21-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 C23H28N2O6S2
Property Insights of C23H28N2O6S2
The XLogP value of 2.5784 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C23H28N2O6S2. The TPSA of 118.12 Ų falls within the moderate polarity range, balancing permeability and solubility for C23H28N2O6S2. Following Lipinski's Rule of Five, C23H28N2O6S2 has 2 hydrogen bond donor(s) and 9 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 C23H28N2O6S2?
The CAS number of C23H28N2O6S2 is 190774-59-5.
What is the molecular formula of C23H28N2O6S2?
The molecular formula of C23H28N2O6S2 is C23H28N2O6S2.
What is the molecular weight of C23H28N2O6S2?
The molecular weight of C23H28N2O6S2 is 492.14 g/mol.
Where can I buy C23H28N2O6S2?
You can request a quote for C23H28N2O6S2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C23H28N2O6S2?
Yes, KEHONG BIO provides custom synthesis services for C23H28N2O6S2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.