Cyclo(glu(O-benzyl)-sar-gly-(N-n-decyl)gly)2
TL;DR: Cyclo(glu(O-benzyl)-sar-gly-(N-n-decyl)gly)2 (CAS 73243-34-2) is a chemical compound with molecular formula C58H88N8O12 and molecular weight 1088.65 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E,4S)-4-amino-6,7-dibenzyl-6-[[(3S,5S)-7-carboxy-5-[[2-(decylamino)acetyl]amino]-3-formyl-1-[[2-(methylamino)acetyl]amino]-2,4-dioxoheptan-3-yl]-[2-[[2-(methylamino)acetyl]amino]acetyl]amino]-5-oxopentadec-7-enoic acid
Also Known As: Decyl-2E, Cyclo(glu(O-benzyl)-sar-gly-(N-n-decyl)gly)2, (E,4S)-4-amino-6,7-dibenzyl-6-[[(3S,5S)-7-carboxy-5-[[2-(decylamino)acetyl]amino]-3-formyl-1-[[2-(methylamino)acetyl]amino]-2,4-dioxoheptan-3-yl]-[2-[[2-(methylamino)acetyl]amino]acetyl]amino]-5-oxopentadec-7-enoic acid, (E,4S)-4-amino-6,7-dibenzyl-6-[[(3S,5S)-5-[[2-(decylamino)acetyl]amino]-3-formyl-8-hydroxy-1-[[2-(methylamino)acetyl]amino]-2,4,8-trioxooctan-3-yl]-[2-[[2-(methylamino)acetyl]amino]acetyl]amino]-5-oxopentadec-7-enoic acid
| Molecular Formula | C58H88N8O12 |
|---|---|
| Molecular Weight | 1088.65 g/mol |
| LogP | 3.9143 |
| Topological Polar Surface Area | 312.6 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 45 |
| Exact Mass | 1088.6522 |
| Heavy Atoms | 78 |
| Complexity | 2246.5686 |
Chemical Identifiers
| CAS Number | 73243-34-2 |
|---|---|
| SMILES | CCCCCCCCCCNCC(=O)N[C@@H](CCC(=O)O)C(=O)[C@](C=O)(C(=O)CNC(=O)CNC)N(C(=O)CNC(=O)CNC)C(CC1=CC=CC=C1)(/C(=C/CCCCCCC)/CC2=CC=CC=C2)C(=O)[C@H](CCC(=O)O)N |
Product Overview
Cyclo(glu(O-benzyl)-sar-gly-(N-n-decyl)gly)2 (CAS 73243-34-2), with molecular formula C58H88N8O12 and molecular weight 1088.65 g/mol. IUPAC: (E,4S)-4-amino-6,7-dibenzyl-6-[[(3S,5S)-7-carboxy-5-[[2-(decylamino)acetyl]amino]-3-formyl-1-[[2-(methylamino)acetyl]amino]-2,4-dioxoheptan-3-yl]-[2-[[2-(methylamino)acetyl]amino]acetyl]amino]-5-oxopentadec-7-enoic acid.
Chemical Property Profile of Cyclo(glu(O-benzyl)-sar-gly-(N-n-decyl)gly)2
Property Insights of Cyclo(glu(O-benzyl)-sar-gly-(N-n-decyl)gly)2
The XLogP value of 3.9143 indicates that Cyclo(glu(O-benzyl)-sar-gly-(N-n-decyl)gly)2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 312.6 Ų indicates high polarity, suggesting Cyclo(glu(O-benzyl)-sar-gly-(N-n-decyl)gly)2 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cyclo(glu(O-benzyl)-sar-gly-(N-n-decyl)gly)2 has 9 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cyclo(glu(O-benzyl)-sar-gly-(N-n-decyl)gly)2?
The CAS number of Cyclo(glu(O-benzyl)-sar-gly-(N-n-decyl)gly)2 is 73243-34-2.
What is the molecular formula of Cyclo(glu(O-benzyl)-sar-gly-(N-n-decyl)gly)2?
The molecular formula of Cyclo(glu(O-benzyl)-sar-gly-(N-n-decyl)gly)2 is C58H88N8O12.
What is the molecular weight of Cyclo(glu(O-benzyl)-sar-gly-(N-n-decyl)gly)2?
The molecular weight of Cyclo(glu(O-benzyl)-sar-gly-(N-n-decyl)gly)2 is 1088.65 g/mol.
Where can I buy Cyclo(glu(O-benzyl)-sar-gly-(N-n-decyl)gly)2?
You can request a quote for Cyclo(glu(O-benzyl)-sar-gly-(N-n-decyl)gly)2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclo(glu(O-benzyl)-sar-gly-(N-n-decyl)gly)2?
Yes, KEHONG BIO provides custom synthesis services for Cyclo(glu(O-benzyl)-sar-gly-(N-n-decyl)gly)2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.