RefChem:123405
TL;DR: RefChem:123405 (CAS 68092-74-0) is a chemical compound with molecular formula C24H26N4O7 and molecular weight 482.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-[[3-(isocyanatomethyl)phenyl]carbamoyloxy]propoxy]propan-2-yl N-[3-(isocyanatomethyl)phenyl]carbamate
Also Known As: oxydipropane-1,2-diyl bis{[3-(isocyanatomethyl)phenyl]carbamate}, Carbamic acid, (3-isocyanatomethylphenyl)-, oxybis(1-methyl-2,1-ethanediyl) ester, Carbamic acid, N-(3-isocyanatomethylphenyl)-, C,C'-(oxybis(1-methyl-2,1-ethanediyl)) ester, Bis[[3-(isocyanatomethyl)phenyl]carbamic acid]oxybis(1-methyl-2,1-ethanediyl) ester, Carbamic acid, N-(3-isocyanatomethylphenyl)-, C,C'-[oxybis(1-methyl-2,1-ethanediyl)] ester
| Molecular Formula | C24H26N4O7 |
|---|---|
| Molecular Weight | 482.18 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 145.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 14 |
| Exact Mass | 482.18015 |
| Heavy Atoms | 35 |
| Complexity | 705.0 |
Chemical Identifiers
| CAS Number | 68092-74-0 |
|---|---|
| SMILES | CC(COCC(C)OC(=O)NC1=CC=CC(=C1)CN=C=O)OC(=O)NC2=CC=CC(=C2)CN=C=O |
| InChIKey | OIKLHRPYUMZODQ-UHFFFAOYSA-N |
Product Overview
RefChem:123405 (CAS 68092-74-0), with molecular formula C24H26N4O7 and molecular weight 482.18 g/mol. IUPAC: 1-[2-[[3-(isocyanatomethyl)phenyl]carbamoyloxy]propoxy]propan-2-yl N-[3-(isocyanatomethyl)phenyl]carbamate.
Chemical Property Profile of RefChem:123405
Property Insights of RefChem:123405
The XLogP value of 5.0 indicates that RefChem:123405 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 145.0 Ų indicates high polarity, suggesting RefChem:123405 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:123405 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 RefChem:123405?
The CAS number of RefChem:123405 is 68092-74-0.
What is the molecular formula of RefChem:123405?
The molecular formula of RefChem:123405 is C24H26N4O7.
What is the molecular weight of RefChem:123405?
The molecular weight of RefChem:123405 is 482.18 g/mol.
Where can I buy RefChem:123405?
You can request a quote for RefChem:123405 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:123405?
Yes, KEHONG BIO provides custom synthesis services for RefChem:123405 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.