exo-THPO
TL;DR: exo-THPO (CAS 496812-66-9) is a chemical compound with molecular formula C7H10N2O2 and molecular weight 154.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-4,5,6,7-tetrahydro-1,2-benzoxazol-3-one
Also Known As: exo-THPO, 4-Amino-4,5,6,7-tetrahydrobenzo[d]isoxazol-3-ol, 4-Amino-4,5,6,7-tetrahydrobenzo[d]isoxazol-3(2H)-one, 4-amino-4,5,6,7-tetrahydro-1,2-benzoxazol-3-ol, 4-amino-4,5,6,7-tetrahydro-1,2-benzoxazol-3-one
| Molecular Formula | C7H10N2O2 |
|---|---|
| Molecular Weight | 154.07 g/mol |
| LogP | 0.304 |
| Topological Polar Surface Area | 72.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 154.07423 |
| Heavy Atoms | 11 |
| Complexity | 312.48563 |
Chemical Identifiers
| CAS Number | 496812-66-9 |
|---|---|
| SMILES | C1CC(C2=C(C1)ONC2=O)N |
Product Overview
exo-THPO (CAS 496812-66-9), with molecular formula C7H10N2O2 and molecular weight 154.07 g/mol. IUPAC: 4-amino-4,5,6,7-tetrahydro-1,2-benzoxazol-3-one.
Chemical Property Profile of exo-THPO
Property Insights of exo-THPO
The XLogP value of 0.304 suggests moderate lipophilicity, balancing water solubility and membrane permeability for exo-THPO. The TPSA of 72.02 Ų falls within the moderate polarity range, balancing permeability and solubility for exo-THPO. Following Lipinski's Rule of Five, exo-THPO has 2 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 exo-THPO?
The CAS number of exo-THPO is 496812-66-9.
What is the molecular formula of exo-THPO?
The molecular formula of exo-THPO is C7H10N2O2.
What is the molecular weight of exo-THPO?
The molecular weight of exo-THPO is 154.07 g/mol.
Where can I buy exo-THPO?
You can request a quote for exo-THPO directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for exo-THPO?
Yes, KEHONG BIO provides custom synthesis services for exo-THPO and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.