5-Amino-2,3-dihydro-1,3-benzoxazol-2-one
TL;DR: 5-Amino-2,3-dihydro-1,3-benzoxazol-2-one (CAS 14733-77-8) is a chemical compound with molecular formula C7H6N2O2 and molecular weight 150.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-3H-1,3-benzoxazol-2-one
Also Known As: 5-Aminobenzo[d]oxazol-2(3H)-one, 2(3H)-Benzoxazolone, 5-amino-, 5-Aminobenzoxazolone, 5-Amino-2-benzoxazolone, 5-Amino-2-benzoxazolinone
| Molecular Formula | C7H6N2O2 |
|---|---|
| Molecular Weight | 150.04 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 150.04292 |
| Heavy Atoms | 11 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 14733-77-8 |
|---|---|
| SMILES | C1=CC2=C(C=C1N)NC(=O)O2 |
| InChIKey | GJXXUHGUCBUXSL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Amino-2,3-dihydro-1,3-benzoxazol-2-one (CAS 14733-77-8), with molecular formula C7H6N2O2 and molecular weight 150.04 g/mol. IUPAC: 5-amino-3H-1,3-benzoxazol-2-one.
Chemical Property Profile of 5-Amino-2,3-dihydro-1,3-benzoxazol-2-one
Property Insights of 5-Amino-2,3-dihydro-1,3-benzoxazol-2-one
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Amino-2,3-dihydro-1,3-benzoxazol-2-one. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Amino-2,3-dihydro-1,3-benzoxazol-2-one. Following Lipinski's Rule of Five, 5-Amino-2,3-dihydro-1,3-benzoxazol-2-one has 2 hydrogen bond donor(s) and 3 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 5-Amino-2,3-dihydro-1,3-benzoxazol-2-one?
The CAS number of 5-Amino-2,3-dihydro-1,3-benzoxazol-2-one is 14733-77-8.
What is the molecular formula of 5-Amino-2,3-dihydro-1,3-benzoxazol-2-one?
The molecular formula of 5-Amino-2,3-dihydro-1,3-benzoxazol-2-one is C7H6N2O2.
What is the molecular weight of 5-Amino-2,3-dihydro-1,3-benzoxazol-2-one?
The molecular weight of 5-Amino-2,3-dihydro-1,3-benzoxazol-2-one is 150.04 g/mol.
Where can I buy 5-Amino-2,3-dihydro-1,3-benzoxazol-2-one?
You can request a quote for 5-Amino-2,3-dihydro-1,3-benzoxazol-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Amino-2,3-dihydro-1,3-benzoxazol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 5-Amino-2,3-dihydro-1,3-benzoxazol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.