6,6-dimethyl-2-phenyl-3-propan-2-yl-5,7-dihydro-3H-1,2-benzoxazol-4-one
TL;DR: 6,6-dimethyl-2-phenyl-3-propan-2-yl-5,7-dihydro-3H-1,2-benzoxazol-4-one (CAS 5676-14-2) is a chemical compound with molecular formula C18H23NO2 and molecular weight 285.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,6-dimethyl-2-phenyl-3-propan-2-yl-5,7-dihydro-3H-1,2-benzoxazol-4-one
Also Known As: 6,6-dimethyl-2-phenyl-3-propan-2-yl-5,7-dihydro-3H-1,2-benzoxazol-4-one, AH-487/11927022, 3-isopropyl-6,6-dimethyl-2-phenyl-3,5,6,7-tetrahydro-1,2-benzisoxazol-4(2H)-one, 3-isopropyl-6,6-dimethyl-2-phenyl-5,7-dihydro-3H-indoxazen-4-one, 6,6-Dimethyl-2-phenyl-3-(propan-2-yl)-3,5,6,7-tetrahydro-1,2-benzoxazol-4(2H)-one
| Molecular Formula | C18H23NO2 |
|---|---|
| Molecular Weight | 285.17 g/mol |
| LogP | 4.106 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 285.17288 |
| Heavy Atoms | 21 |
| Complexity | 586.4957 |
Chemical Identifiers
| CAS Number | 5676-14-2 |
|---|---|
| SMILES | CC(C)C1C2=C(CC(CC2=O)(C)C)ON1C3=CC=CC=C3 |
Product Overview
6,6-dimethyl-2-phenyl-3-propan-2-yl-5,7-dihydro-3H-1,2-benzoxazol-4-one (CAS 5676-14-2), with molecular formula C18H23NO2 and molecular weight 285.17 g/mol. IUPAC: 6,6-dimethyl-2-phenyl-3-propan-2-yl-5,7-dihydro-3H-1,2-benzoxazol-4-one.
Chemical Property Profile of 6,6-dimethyl-2-phenyl-3-propan-2-yl-5,7-dihydro-3H-1,2-benzoxazol-4-one
Property Insights of 6,6-dimethyl-2-phenyl-3-propan-2-yl-5,7-dihydro-3H-1,2-benzoxazol-4-one
The XLogP value of 4.106 indicates that 6,6-dimethyl-2-phenyl-3-propan-2-yl-5,7-dihydro-3H-1,2-benzoxazol-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, 6,6-dimethyl-2-phenyl-3-propan-2-yl-5,7-dihydro-3H-1,2-benzoxazol-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,6-dimethyl-2-phenyl-3-propan-2-yl-5,7-dihydro-3H-1,2-benzoxazol-4-one has 0 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 6,6-dimethyl-2-phenyl-3-propan-2-yl-5,7-dihydro-3H-1,2-benzoxazol-4-one?
The CAS number of 6,6-dimethyl-2-phenyl-3-propan-2-yl-5,7-dihydro-3H-1,2-benzoxazol-4-one is 5676-14-2.
What is the molecular formula of 6,6-dimethyl-2-phenyl-3-propan-2-yl-5,7-dihydro-3H-1,2-benzoxazol-4-one?
The molecular formula of 6,6-dimethyl-2-phenyl-3-propan-2-yl-5,7-dihydro-3H-1,2-benzoxazol-4-one is C18H23NO2.
What is the molecular weight of 6,6-dimethyl-2-phenyl-3-propan-2-yl-5,7-dihydro-3H-1,2-benzoxazol-4-one?
The molecular weight of 6,6-dimethyl-2-phenyl-3-propan-2-yl-5,7-dihydro-3H-1,2-benzoxazol-4-one is 285.17 g/mol.
Where can I buy 6,6-dimethyl-2-phenyl-3-propan-2-yl-5,7-dihydro-3H-1,2-benzoxazol-4-one?
You can request a quote for 6,6-dimethyl-2-phenyl-3-propan-2-yl-5,7-dihydro-3H-1,2-benzoxazol-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,6-dimethyl-2-phenyl-3-propan-2-yl-5,7-dihydro-3H-1,2-benzoxazol-4-one?
Yes, KEHONG BIO provides custom synthesis services for 6,6-dimethyl-2-phenyl-3-propan-2-yl-5,7-dihydro-3H-1,2-benzoxazol-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.