2-(4-Dimethylamino-phenyl)-benzooxazol-5-ylamine
TL;DR: 2-(4-Dimethylamino-phenyl)-benzooxazol-5-ylamine (CAS 116248-11-4) is a chemical compound with molecular formula C15H15N3O and molecular weight 253.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(dimethylamino)phenyl]-1,3-benzoxazol-5-amine
Also Known As: 2-(4-Dimethylamino-phenyl)-benzooxazol-5-ylamine, ChemDiv2_000117, 2-[4-(dimethylamino)phenyl]-1,3-benzoxazol-5-amine, 2-(4-(dimethylamino)phenyl)benzo[d]oxazol-5-amine, NITROSONIUMHEXAFLUOROPHOSPHATE
| Molecular Formula | C15H15N3O |
|---|---|
| Molecular Weight | 253.12 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 55.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 253.1215 |
| Heavy Atoms | 19 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 116248-11-4 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)N |
| InChIKey | TZIJEHNHNLJSSH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(4-Dimethylamino-phenyl)-benzooxazol-5-ylamine (CAS 116248-11-4), with molecular formula C15H15N3O and molecular weight 253.12 g/mol. IUPAC: 2-[4-(dimethylamino)phenyl]-1,3-benzoxazol-5-amine.
Chemical Property Profile of 2-(4-Dimethylamino-phenyl)-benzooxazol-5-ylamine
Property Insights of 2-(4-Dimethylamino-phenyl)-benzooxazol-5-ylamine
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Dimethylamino-phenyl)-benzooxazol-5-ylamine. With a topological polar surface area (TPSA) of 55.3 Ų, 2-(4-Dimethylamino-phenyl)-benzooxazol-5-ylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Dimethylamino-phenyl)-benzooxazol-5-ylamine 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 2-(4-Dimethylamino-phenyl)-benzooxazol-5-ylamine?
The CAS number of 2-(4-Dimethylamino-phenyl)-benzooxazol-5-ylamine is 116248-11-4.
What is the molecular formula of 2-(4-Dimethylamino-phenyl)-benzooxazol-5-ylamine?
The molecular formula of 2-(4-Dimethylamino-phenyl)-benzooxazol-5-ylamine is C15H15N3O.
What is the molecular weight of 2-(4-Dimethylamino-phenyl)-benzooxazol-5-ylamine?
The molecular weight of 2-(4-Dimethylamino-phenyl)-benzooxazol-5-ylamine is 253.12 g/mol.
Where can I buy 2-(4-Dimethylamino-phenyl)-benzooxazol-5-ylamine?
You can request a quote for 2-(4-Dimethylamino-phenyl)-benzooxazol-5-ylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Dimethylamino-phenyl)-benzooxazol-5-ylamine?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Dimethylamino-phenyl)-benzooxazol-5-ylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.