DEHYDROTREWIASINE B820915K138
TL;DR: DEHYDROTREWIASINE B820915K138 (CAS 78987-27-6) is a chemical compound with molecular formula C37H50ClN3O11 and molecular weight 747.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(11-chloro-21-hydroxy-12,15,20-trimethoxy-2,5,9,16-tetramethyl-8,23-dioxo-4,24-dioxa-9,22-diazatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl) 2-[methyl(2-methylprop-2-enoyl)amino]propanoate
Also Known As: DEHYDROTREWIASINE B820915K138
| Molecular Formula | C37H50ClN3O11 |
|---|---|
| Molecular Weight | 747.31 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 166.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 8 |
| Exact Mass | 747.3134 |
| Heavy Atoms | 52 |
| Complexity | 1440.0 |
Chemical Identifiers
| CAS Number | 78987-27-6 |
|---|---|
| SMILES | CC1C2CC(C(C=CC=C(C(C3=CC(=C(C(=C3)OC)Cl)N(C(=O)CC(C4(C1O4)C)OC(=O)C(C)N(C)C(=O)C(=C)C)C)OC)C)OC)(NC(=O)O2)O |
| InChIKey | SYEBRFJSVSBINL-UHFFFAOYSA-N |
Product Overview
DEHYDROTREWIASINE B820915K138 (CAS 78987-27-6), with molecular formula C37H50ClN3O11 and molecular weight 747.31 g/mol. IUPAC: (11-chloro-21-hydroxy-12,15,20-trimethoxy-2,5,9,16-tetramethyl-8,23-dioxo-4,24-dioxa-9,22-diazatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl) 2-[methyl(2-methylprop-2-enoyl)amino]propanoate.
Chemical Property Profile of DEHYDROTREWIASINE B820915K138
Property Insights of DEHYDROTREWIASINE B820915K138
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for DEHYDROTREWIASINE B820915K138. The TPSA of 166.0 Ų indicates high polarity, suggesting DEHYDROTREWIASINE B820915K138 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, DEHYDROTREWIASINE B820915K138 has 2 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of DEHYDROTREWIASINE B820915K138?
The CAS number of DEHYDROTREWIASINE B820915K138 is 78987-27-6.
What is the molecular formula of DEHYDROTREWIASINE B820915K138?
The molecular formula of DEHYDROTREWIASINE B820915K138 is C37H50ClN3O11.
What is the molecular weight of DEHYDROTREWIASINE B820915K138?
The molecular weight of DEHYDROTREWIASINE B820915K138 is 747.31 g/mol.
Where can I buy DEHYDROTREWIASINE B820915K138?
You can request a quote for DEHYDROTREWIASINE B820915K138 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DEHYDROTREWIASINE B820915K138?
Yes, KEHONG BIO provides custom synthesis services for DEHYDROTREWIASINE B820915K138 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.