N-(4,5,6,7-Tetrahydro-1-benzothiophen-4-yl)-4,5-dihydro-1,3-oxazol-2-amine
TL;DR: N-(4,5,6,7-Tetrahydro-1-benzothiophen-4-yl)-4,5-dihydro-1,3-oxazol-2-amine (CAS 27632-16-2) is a chemical compound with molecular formula C11H14N2OS and molecular weight 222.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)-4,5-dihydro-1,3-oxazol-2-amine
Also Known As: 2-(4,5,6,7-Tetrahydro-benzothiophen-4-ylamino)-2-oxazoline, N-(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)-4,5-dihydro-1,3-oxazol-2-amine, 4,5,6,7-Tetrahydro-N-(2-oxazolin-2-yl)-4-benzo(b)thiophenamine, 4-BENZO(b)THIOPHENAMINE, 4,5,6,7-TETRAHYDRO-N-(2-OXAZOLIN-2-YL)-, 4,5,6,7-Tetrahydro-N-(2-oxazolin-2-yl)benzo[b]thiophen-4-amine
| Molecular Formula | C11H14N2OS |
|---|---|
| Molecular Weight | 222.08 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 61.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 222.08269 |
| Heavy Atoms | 15 |
| Complexity | 269.0 |
Chemical Identifiers
| CAS Number | 27632-16-2 |
|---|---|
| SMILES | C1CC(C2=C(C1)SC=C2)NC3=NCCO3 |
| InChIKey | AGFSEWXNGDAJGV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(4,5,6,7-Tetrahydro-1-benzothiophen-4-yl)-4,5-dihydro-1,3-oxazol-2-amine (CAS 27632-16-2), with molecular formula C11H14N2OS and molecular weight 222.08 g/mol. IUPAC: N-(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)-4,5-dihydro-1,3-oxazol-2-amine.
Chemical Property Profile of N-(4,5,6,7-Tetrahydro-1-benzothiophen-4-yl)-4,5-dihydro-1,3-oxazol-2-amine
Property Insights of N-(4,5,6,7-Tetrahydro-1-benzothiophen-4-yl)-4,5-dihydro-1,3-oxazol-2-amine
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4,5,6,7-Tetrahydro-1-benzothiophen-4-yl)-4,5-dihydro-1,3-oxazol-2-amine. The TPSA of 61.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4,5,6,7-Tetrahydro-1-benzothiophen-4-yl)-4,5-dihydro-1,3-oxazol-2-amine. Following Lipinski's Rule of Five, N-(4,5,6,7-Tetrahydro-1-benzothiophen-4-yl)-4,5-dihydro-1,3-oxazol-2-amine 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 N-(4,5,6,7-Tetrahydro-1-benzothiophen-4-yl)-4,5-dihydro-1,3-oxazol-2-amine?
The CAS number of N-(4,5,6,7-Tetrahydro-1-benzothiophen-4-yl)-4,5-dihydro-1,3-oxazol-2-amine is 27632-16-2.
What is the molecular formula of N-(4,5,6,7-Tetrahydro-1-benzothiophen-4-yl)-4,5-dihydro-1,3-oxazol-2-amine?
The molecular formula of N-(4,5,6,7-Tetrahydro-1-benzothiophen-4-yl)-4,5-dihydro-1,3-oxazol-2-amine is C11H14N2OS.
What is the molecular weight of N-(4,5,6,7-Tetrahydro-1-benzothiophen-4-yl)-4,5-dihydro-1,3-oxazol-2-amine?
The molecular weight of N-(4,5,6,7-Tetrahydro-1-benzothiophen-4-yl)-4,5-dihydro-1,3-oxazol-2-amine is 222.08 g/mol.
Where can I buy N-(4,5,6,7-Tetrahydro-1-benzothiophen-4-yl)-4,5-dihydro-1,3-oxazol-2-amine?
You can request a quote for N-(4,5,6,7-Tetrahydro-1-benzothiophen-4-yl)-4,5-dihydro-1,3-oxazol-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4,5,6,7-Tetrahydro-1-benzothiophen-4-yl)-4,5-dihydro-1,3-oxazol-2-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(4,5,6,7-Tetrahydro-1-benzothiophen-4-yl)-4,5-dihydro-1,3-oxazol-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.