57-Normajusculamide C
TL;DR: 57-Normajusculamide C (CAS 13952-05-1) is a chemical compound with molecular formula C49H78N8O12 and molecular weight 970.57 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-butan-2-yl-28-ethyl-17-[(4-methoxyphenyl)methyl]-7,13,16,20,22,22,25,29-octamethyl-2,14-di(propan-2-yl)-1-oxa-4,7,10,13,16,19,24,27-octazacyclotriacontane-3,6,9,12,15,18,21,23,26,30-decone
Also Known As: 57-Normajusculamide C, Majusculamide C,3-[(2S)-2-hydroxy-3-methylbutanoic acid]- (9CI), 8-(butan-2-yl)-28-ethyl-17-(4-methoxybenzyl)-7,13,16,20,22,22,25,29-octamethyl-2,14-di(propan-2-yl)-1-oxa-4,7,10,13,16,19,24,27-octaazacyclotriacontane-3,6,9,12,15,18,21,23,26,30-decone, 8-butan-2-yl-28-ethyl-17-[(4-methoxyphenyl)methyl]-7,13,16,20,22,22,25,29-octamethyl-2,14-di(propan-2-yl)-1-oxa-4,7,10,13,16,19,24,27-octazacyclotriacontane-3,6,9,12,15,18,21,23,26,30-decone
| Molecular Formula | C49H78N8O12 |
|---|---|
| Molecular Weight | 970.57 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 259.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 8 |
| Exact Mass | 970.5739 |
| Heavy Atoms | 69 |
| Complexity | 1850.0 |
Chemical Identifiers
| CAS Number | 13952-05-1 |
|---|---|
| SMILES | CCC1C(C(=O)OC(C(=O)NCC(=O)N(C(C(=O)NCC(=O)N(C(C(=O)N(C(C(=O)NC(C(=O)C(C(=O)NC(C(=O)N1)C)(C)C)C)CC2=CC=C(C=C2)OC)C)C(C)C)C)C(C)CC)C)C(C)C)C |
| InChIKey | NDFBQYCGCBEBOD-UHFFFAOYSA-N |
Product Overview
57-Normajusculamide C (CAS 13952-05-1), with molecular formula C49H78N8O12 and molecular weight 970.57 g/mol. IUPAC: 8-butan-2-yl-28-ethyl-17-[(4-methoxyphenyl)methyl]-7,13,16,20,22,22,25,29-octamethyl-2,14-di(propan-2-yl)-1-oxa-4,7,10,13,16,19,24,27-octazacyclotriacontane-3,6,9,12,15,18,21,23,26,30-decone.
Chemical Property Profile of 57-Normajusculamide C
Property Insights of 57-Normajusculamide C
The XLogP value of 4.8 indicates that 57-Normajusculamide C is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 259.0 Ų indicates high polarity, suggesting 57-Normajusculamide C may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 57-Normajusculamide C has 5 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 57-Normajusculamide C?
The CAS number of 57-Normajusculamide C is 13952-05-1.
What is the molecular formula of 57-Normajusculamide C?
The molecular formula of 57-Normajusculamide C is C49H78N8O12.
What is the molecular weight of 57-Normajusculamide C?
The molecular weight of 57-Normajusculamide C is 970.57 g/mol.
Where can I buy 57-Normajusculamide C?
You can request a quote for 57-Normajusculamide C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 57-Normajusculamide C?
Yes, KEHONG BIO provides custom synthesis services for 57-Normajusculamide C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.