2-(3-Amino-4-methylphenyl)-1,3-benzoxazol-5-amine
TL;DR: 2-(3-Amino-4-methylphenyl)-1,3-benzoxazol-5-amine (CAS 313527-65-0) is a chemical compound with molecular formula C14H13N3O and molecular weight 239.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-amino-4-methylphenyl)-1,3-benzoxazol-5-amine
Also Known As: BAS 08885950, 2-(3-amino-4-methylphenyl)-1,3-benzoxazol-5-amine, BB 0245433, 2-(3-amino-4-methylphenyl)benzo[d]oxazol-5-amine, 2-(3-Amino-4-methyl-phenyl)-benzooxazol-5-ylamine
| Molecular Formula | C14H13N3O |
|---|---|
| Molecular Weight | 239.11 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 78.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 239.10587 |
| Heavy Atoms | 18 |
| Complexity | 299.0 |
Chemical Identifiers
| CAS Number | 313527-65-0 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)N)N |
| InChIKey | UTPASCSQJKDJIL-UHFFFAOYSA-N |
Product Overview
2-(3-Amino-4-methylphenyl)-1,3-benzoxazol-5-amine (CAS 313527-65-0), with molecular formula C14H13N3O and molecular weight 239.11 g/mol. IUPAC: 2-(3-amino-4-methylphenyl)-1,3-benzoxazol-5-amine.
Chemical Property Profile of 2-(3-Amino-4-methylphenyl)-1,3-benzoxazol-5-amine
Property Insights of 2-(3-Amino-4-methylphenyl)-1,3-benzoxazol-5-amine
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Amino-4-methylphenyl)-1,3-benzoxazol-5-amine. The TPSA of 78.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Amino-4-methylphenyl)-1,3-benzoxazol-5-amine. Following Lipinski's Rule of Five, 2-(3-Amino-4-methylphenyl)-1,3-benzoxazol-5-amine 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 2-(3-Amino-4-methylphenyl)-1,3-benzoxazol-5-amine?
The CAS number of 2-(3-Amino-4-methylphenyl)-1,3-benzoxazol-5-amine is 313527-65-0.
What is the molecular formula of 2-(3-Amino-4-methylphenyl)-1,3-benzoxazol-5-amine?
The molecular formula of 2-(3-Amino-4-methylphenyl)-1,3-benzoxazol-5-amine is C14H13N3O.
What is the molecular weight of 2-(3-Amino-4-methylphenyl)-1,3-benzoxazol-5-amine?
The molecular weight of 2-(3-Amino-4-methylphenyl)-1,3-benzoxazol-5-amine is 239.11 g/mol.
Where can I buy 2-(3-Amino-4-methylphenyl)-1,3-benzoxazol-5-amine?
You can request a quote for 2-(3-Amino-4-methylphenyl)-1,3-benzoxazol-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Amino-4-methylphenyl)-1,3-benzoxazol-5-amine?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Amino-4-methylphenyl)-1,3-benzoxazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.