Benzoxazole, 2-amino-5-chloro-6-methoxy-
TL;DR: Benzoxazole, 2-amino-5-chloro-6-methoxy- (CAS 2139-00-6) is a chemical compound with molecular formula C8H7ClN2O2 and molecular weight 198.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-6-methoxy-1,3-benzoxazol-2-amine
Also Known As: 2-Amino-5-chloro-6-methoxybenzoxazole, 5-chloro-6-methoxy-1,3-benzoxazol-2-amine, 2-Benzoxazolamine,5-chloro-6-methoxy-, BENZOXAZOLE, 2-AMINO-5-CHLORO-6-METHOXY-, 5-chloro-6-methoxybenzo[d]oxazol-2-amine
| Molecular Formula | C8H7ClN2O2 |
|---|---|
| Molecular Weight | 198.02 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 61.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 198.0196 |
| Heavy Atoms | 13 |
| Complexity | 193.0 |
Chemical Identifiers
| CAS Number | 2139-00-6 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)OC(=N2)N)Cl |
| InChIKey | GOYJQKVVEOIVCJ-UHFFFAOYSA-N |
Product Overview
Benzoxazole, 2-amino-5-chloro-6-methoxy- (CAS 2139-00-6), with molecular formula C8H7ClN2O2 and molecular weight 198.02 g/mol. IUPAC: 5-chloro-6-methoxy-1,3-benzoxazol-2-amine.
Chemical Property Profile of Benzoxazole, 2-amino-5-chloro-6-methoxy-
Property Insights of Benzoxazole, 2-amino-5-chloro-6-methoxy-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoxazole, 2-amino-5-chloro-6-methoxy-. The TPSA of 61.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoxazole, 2-amino-5-chloro-6-methoxy-. Following Lipinski's Rule of Five, Benzoxazole, 2-amino-5-chloro-6-methoxy- has 1 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 Benzoxazole, 2-amino-5-chloro-6-methoxy-?
The CAS number of Benzoxazole, 2-amino-5-chloro-6-methoxy- is 2139-00-6.
What is the molecular formula of Benzoxazole, 2-amino-5-chloro-6-methoxy-?
The molecular formula of Benzoxazole, 2-amino-5-chloro-6-methoxy- is C8H7ClN2O2.
What is the molecular weight of Benzoxazole, 2-amino-5-chloro-6-methoxy-?
The molecular weight of Benzoxazole, 2-amino-5-chloro-6-methoxy- is 198.02 g/mol.
Where can I buy Benzoxazole, 2-amino-5-chloro-6-methoxy-?
You can request a quote for Benzoxazole, 2-amino-5-chloro-6-methoxy- 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-5-chloro-6-methoxy-?
Yes, KEHONG BIO provides custom synthesis services for Benzoxazole, 2-amino-5-chloro-6-methoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.