Union carbide UC-30045
TL;DR: Union carbide UC-30045 (CAS 13613-99-5) 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.
[4-(methoxycarbonylamino)-3-propan-2-ylphenyl] N-methylcarbamate
Also Known As: Union carbide UC-30045, ENT 27,393, AI3-27393, UC 30,045, Methyl-2-isopropyl-4-(methylcarbamoyloxy)carbanilate
| Molecular Formula | C13H18N2O4 |
|---|---|
| Molecular Weight | 266.13 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 76.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 266.12665 |
| Heavy Atoms | 19 |
| Complexity | 320.0 |
Chemical Identifiers
| CAS Number | 13613-99-5 |
|---|---|
| SMILES | CC(C)C1=C(C=CC(=C1)OC(=O)NC)NC(=O)OC |
| InChIKey | WGJLFLRXAJFNTC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Union carbide UC-30045 (CAS 13613-99-5), with molecular formula C13H18N2O4 and molecular weight 266.13 g/mol. IUPAC: [4-(methoxycarbonylamino)-3-propan-2-ylphenyl] N-methylcarbamate.
Chemical Property Profile of Union carbide UC-30045
Property Insights of Union carbide UC-30045
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Union carbide UC-30045. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Union carbide UC-30045. Following Lipinski's Rule of Five, Union carbide UC-30045 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 Union carbide UC-30045?
The CAS number of Union carbide UC-30045 is 13613-99-5.
What is the molecular formula of Union carbide UC-30045?
The molecular formula of Union carbide UC-30045 is C13H18N2O4.
What is the molecular weight of Union carbide UC-30045?
The molecular weight of Union carbide UC-30045 is 266.13 g/mol.
Where can I buy Union carbide UC-30045?
You can request a quote for Union carbide UC-30045 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Union carbide UC-30045?
Yes, KEHONG BIO provides custom synthesis services for Union carbide UC-30045 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.