benzyl N-(12-methyl-2,5,11,14-tetraoxo-3-propan-2-yl-1-oxa-4,10,13-triazacyclohexadec-15-yl)carbamate
TL;DR: benzyl N-(12-methyl-2,5,11,14-tetraoxo-3-propan-2-yl-1-oxa-4,10,13-triazacyclohexadec-15-yl)carbamate (CAS 56411-59-7) is a chemical compound with molecular formula C24H34N4O7 and molecular weight 490.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl N-(12-methyl-2,5,11,14-tetraoxo-3-propan-2-yl-1-oxa-4,10,13-triazacyclohexadec-15-yl)carbamate
Also Known As: benzyl N-(12-methyl-2,5,11,14-tetraoxo-3-propan-2-yl-1-oxa-4,10,13-triazacyclohexadec-15-yl)carbamate, Benzyl [12-methyl-2,5,11,14-tetraoxo-3-(propan-2-yl)-1-oxa-4,10,13-triazacyclohexadecan-15-yl]carbamate, Benzyl L,L,L-(3-isopropyl-12-methyl-2,5,11,14-tetraoxo-1-oxa-4,10,13-triazacyclohexadecan-15-yl)carbamate, benzyl N-(3-isopropyl-12-methyl-2,5,11,14-tetraoxo-1-oxa-4,10,13-triazacyclohexadec-15-yl)carbamate
| Molecular Formula | C24H34N4O7 |
|---|---|
| Molecular Weight | 490.24 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 152.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 490.24274 |
| Heavy Atoms | 35 |
| Complexity | 752.0 |
Chemical Identifiers
| CAS Number | 56411-59-7 |
|---|---|
| SMILES | CC1C(=O)NCCCCC(=O)NC(C(=O)OCC(C(=O)N1)NC(=O)OCC2=CC=CC=C2)C(C)C |
| InChIKey | GCQGHIATCQFKJE-UHFFFAOYSA-N |
Product Overview
benzyl N-(12-methyl-2,5,11,14-tetraoxo-3-propan-2-yl-1-oxa-4,10,13-triazacyclohexadec-15-yl)carbamate (CAS 56411-59-7), with molecular formula C24H34N4O7 and molecular weight 490.24 g/mol. IUPAC: benzyl N-(12-methyl-2,5,11,14-tetraoxo-3-propan-2-yl-1-oxa-4,10,13-triazacyclohexadec-15-yl)carbamate.
Chemical Property Profile of benzyl N-(12-methyl-2,5,11,14-tetraoxo-3-propan-2-yl-1-oxa-4,10,13-triazacyclohexadec-15-yl)carbamate
Property Insights of benzyl N-(12-methyl-2,5,11,14-tetraoxo-3-propan-2-yl-1-oxa-4,10,13-triazacyclohexadec-15-yl)carbamate
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for benzyl N-(12-methyl-2,5,11,14-tetraoxo-3-propan-2-yl-1-oxa-4,10,13-triazacyclohexadec-15-yl)carbamate. The TPSA of 152.0 Ų indicates high polarity, suggesting benzyl N-(12-methyl-2,5,11,14-tetraoxo-3-propan-2-yl-1-oxa-4,10,13-triazacyclohexadec-15-yl)carbamate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, benzyl N-(12-methyl-2,5,11,14-tetraoxo-3-propan-2-yl-1-oxa-4,10,13-triazacyclohexadec-15-yl)carbamate has 4 hydrogen bond donor(s) and 7 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 benzyl N-(12-methyl-2,5,11,14-tetraoxo-3-propan-2-yl-1-oxa-4,10,13-triazacyclohexadec-15-yl)carbamate?
The CAS number of benzyl N-(12-methyl-2,5,11,14-tetraoxo-3-propan-2-yl-1-oxa-4,10,13-triazacyclohexadec-15-yl)carbamate is 56411-59-7.
What is the molecular formula of benzyl N-(12-methyl-2,5,11,14-tetraoxo-3-propan-2-yl-1-oxa-4,10,13-triazacyclohexadec-15-yl)carbamate?
The molecular formula of benzyl N-(12-methyl-2,5,11,14-tetraoxo-3-propan-2-yl-1-oxa-4,10,13-triazacyclohexadec-15-yl)carbamate is C24H34N4O7.
What is the molecular weight of benzyl N-(12-methyl-2,5,11,14-tetraoxo-3-propan-2-yl-1-oxa-4,10,13-triazacyclohexadec-15-yl)carbamate?
The molecular weight of benzyl N-(12-methyl-2,5,11,14-tetraoxo-3-propan-2-yl-1-oxa-4,10,13-triazacyclohexadec-15-yl)carbamate is 490.24 g/mol.
Where can I buy benzyl N-(12-methyl-2,5,11,14-tetraoxo-3-propan-2-yl-1-oxa-4,10,13-triazacyclohexadec-15-yl)carbamate?
You can request a quote for benzyl N-(12-methyl-2,5,11,14-tetraoxo-3-propan-2-yl-1-oxa-4,10,13-triazacyclohexadec-15-yl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for benzyl N-(12-methyl-2,5,11,14-tetraoxo-3-propan-2-yl-1-oxa-4,10,13-triazacyclohexadec-15-yl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for benzyl N-(12-methyl-2,5,11,14-tetraoxo-3-propan-2-yl-1-oxa-4,10,13-triazacyclohexadec-15-yl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.