Benzoxazole, 2-amino-4-chloro-
TL;DR: Benzoxazole, 2-amino-4-chloro- (CAS 64037-10-1) is a chemical compound with molecular formula C7H5ClN2O and molecular weight 168.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-1,3-benzoxazol-2-amine
Also Known As: 4-Chlorobenzo[d]oxazol-2-amine, 2-Amino-4-chlorobenzoxazole, 4-Chloro-2-benzoxazolamine, 4-chloro-1,3-benzoxazol-2-amine, chlorobenzoxazolamine
| Molecular Formula | C7H5ClN2O |
|---|---|
| Molecular Weight | 168.01 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 52.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 168.00903 |
| Heavy Atoms | 11 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 64037-10-1 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)Cl)N=C(O2)N |
| InChIKey | LMTOFAYSICBYRU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzoxazole, 2-amino-4-chloro- (CAS 64037-10-1), with molecular formula C7H5ClN2O and molecular weight 168.01 g/mol. IUPAC: 4-chloro-1,3-benzoxazol-2-amine.
Chemical Property Profile of Benzoxazole, 2-amino-4-chloro-
Property Insights of Benzoxazole, 2-amino-4-chloro-
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoxazole, 2-amino-4-chloro-. With a topological polar surface area (TPSA) of 52.1 Ų, Benzoxazole, 2-amino-4-chloro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoxazole, 2-amino-4-chloro- has 1 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 Benzoxazole, 2-amino-4-chloro-?
The CAS number of Benzoxazole, 2-amino-4-chloro- is 64037-10-1.
What is the molecular formula of Benzoxazole, 2-amino-4-chloro-?
The molecular formula of Benzoxazole, 2-amino-4-chloro- is C7H5ClN2O.
What is the molecular weight of Benzoxazole, 2-amino-4-chloro-?
The molecular weight of Benzoxazole, 2-amino-4-chloro- is 168.01 g/mol.
Where can I buy Benzoxazole, 2-amino-4-chloro-?
You can request a quote for Benzoxazole, 2-amino-4-chloro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoxazole, 2-amino-4-chloro-?
Yes, KEHONG BIO provides custom synthesis services for Benzoxazole, 2-amino-4-chloro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.