Carbamic acid, (3-boronophenyl)-, C-(phenylmethyl) ester
TL;DR: Carbamic acid, (3-boronophenyl)-, C-(phenylmethyl) ester (CAS 276669-75-1) is a chemical compound with molecular formula C14H14BNO4 and molecular weight 271.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(phenylmethoxycarbonylamino)phenyl]boronic acid
Also Known As: Amide and sulfonamide derivatives, 18, (3-{[(benzyloxy)carbonyl]amino}phenyl)boronic acid, (3-(((Benzyloxy)carbonyl)amino)phenyl)boronic acid, (3-phenylmethoxycarbonylaminophenyl)boronic Acid, Carbamic acid, (3-boronophenyl)-, C-(phenylmethyl) ester
| Molecular Formula | C14H14BNO4 |
|---|---|
| Molecular Weight | 271.10 g/mol |
| LogP | 1.1151 |
| Topological Polar Surface Area | 78.79 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 271.1016 |
| Heavy Atoms | 20 |
| Complexity | 574.3964 |
Chemical Identifiers
| CAS Number | 276669-75-1 |
|---|---|
| SMILES | B(C1=CC(=CC=C1)NC(=O)OCC2=CC=CC=C2)(O)O |
Product Overview
Carbamic acid, (3-boronophenyl)-, C-(phenylmethyl) ester (CAS 276669-75-1), with molecular formula C14H14BNO4 and molecular weight 271.10 g/mol. IUPAC: [3-(phenylmethoxycarbonylamino)phenyl]boronic acid.
Chemical Property Profile of Carbamic acid, (3-boronophenyl)-, C-(phenylmethyl) ester
Property Insights of Carbamic acid, (3-boronophenyl)-, C-(phenylmethyl) ester
The XLogP value of 1.1151 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, (3-boronophenyl)-, C-(phenylmethyl) ester. The TPSA of 78.79 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamic acid, (3-boronophenyl)-, C-(phenylmethyl) ester. Following Lipinski's Rule of Five, Carbamic acid, (3-boronophenyl)-, C-(phenylmethyl) ester has 3 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 Carbamic acid, (3-boronophenyl)-, C-(phenylmethyl) ester?
The CAS number of Carbamic acid, (3-boronophenyl)-, C-(phenylmethyl) ester is 276669-75-1.
What is the molecular formula of Carbamic acid, (3-boronophenyl)-, C-(phenylmethyl) ester?
The molecular formula of Carbamic acid, (3-boronophenyl)-, C-(phenylmethyl) ester is C14H14BNO4.
What is the molecular weight of Carbamic acid, (3-boronophenyl)-, C-(phenylmethyl) ester?
The molecular weight of Carbamic acid, (3-boronophenyl)-, C-(phenylmethyl) ester is 271.10 g/mol.
Where can I buy Carbamic acid, (3-boronophenyl)-, C-(phenylmethyl) ester?
You can request a quote for Carbamic acid, (3-boronophenyl)-, C-(phenylmethyl) ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid, (3-boronophenyl)-, C-(phenylmethyl) ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, (3-boronophenyl)-, C-(phenylmethyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.