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Ethyl N-[(ethoxycarbonylamino)-phenyl-methyl]carbamate
TL;DR: Ethyl N-[(ethoxycarbonylamino)-phenyl-methyl]carbamate (CAS 41658-12-2) is a chemical compound with molecular formula C13H18N2O4 and molecular weight 266.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[(ethoxycarbonylamino)-phenylmethyl]carbamate
Also Known As: Benzyliden-bisurethan, diethyl(phenylmethylene)biscarbamate, ethylN-[ -phenyl-methyl]carbamate, diethyl (phenylmethanediyl)biscarbamate, Diethyl (phenylmethylene)biscarbamate
| Molecular Formula | C13H18N2O4 |
|---|---|
| Molecular Weight | 266.13 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 76.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 266.12665 |
| Heavy Atoms | 19 |
| Complexity | 270.0 |
Chemical Identifiers
| CAS Number | 41658-12-2 |
|---|---|
| SMILES | CCOC(=O)NC(C1=CC=CC=C1)NC(=O)OCC |
| InChIKey | RQHLPJYRTSWDRG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl N-[(ethoxycarbonylamino)-phenyl-methyl]carbamate (CAS 41658-12-2), with molecular formula C13H18N2O4 and molecular weight 266.13 g/mol. IUPAC: ethyl N-[(ethoxycarbonylamino)-phenylmethyl]carbamate.
Chemical Property Profile of Ethyl N-[(ethoxycarbonylamino)-phenyl-methyl]carbamate
Property Insights of Ethyl N-[(ethoxycarbonylamino)-phenyl-methyl]carbamate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl N-[(ethoxycarbonylamino)-phenyl-methyl]carbamate. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl N-[(ethoxycarbonylamino)-phenyl-methyl]carbamate. Following Lipinski's Rule of Five, Ethyl N-[(ethoxycarbonylamino)-phenyl-methyl]carbamate has 2 hydrogen bond donor(s) and 4 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 Ethyl N-[(ethoxycarbonylamino)-phenyl-methyl]carbamate?
The CAS number of Ethyl N-[(ethoxycarbonylamino)-phenyl-methyl]carbamate is 41658-12-2.
What is the molecular formula of Ethyl N-[(ethoxycarbonylamino)-phenyl-methyl]carbamate?
The molecular formula of Ethyl N-[(ethoxycarbonylamino)-phenyl-methyl]carbamate is C13H18N2O4.
What is the molecular weight of Ethyl N-[(ethoxycarbonylamino)-phenyl-methyl]carbamate?
The molecular weight of Ethyl N-[(ethoxycarbonylamino)-phenyl-methyl]carbamate is 266.13 g/mol.
Where can I buy Ethyl N-[(ethoxycarbonylamino)-phenyl-methyl]carbamate?
You can request a quote for Ethyl N-[(ethoxycarbonylamino)-phenyl-methyl]carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl N-[(ethoxycarbonylamino)-phenyl-methyl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl N-[(ethoxycarbonylamino)-phenyl-methyl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.