![N-[3-(1H-imidazol-1-yl)propyl]-3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide structure](/static/products/832/832684-25-0.png)
N-[3-(1H-imidazol-1-yl)propyl]-3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide
TL;DR: N-[3-(1H-imidazol-1-yl)propyl]-3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide (CAS 832684-25-0) is a chemical compound with molecular formula C18H23N3O3 and molecular weight 329.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-imidazol-1-ylpropyl)-3,6,6-trimethyl-4-oxo-5,7-dihydro-1-benzofuran-2-carboxamide
Also Known As: N-[3-(1H-imidazol-1-yl)propyl]-3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide, N-(3-imidazol-1-ylpropyl)-3,6,6-trimethyl-4-oxo-5,7-dihydro-1-benzofuran-2-carboxamide, N-(3-(1H-imidazol-1-yl)propyl)-3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydrobenzofuran-2-carboxamide, N-(3-imidazolylpropyl)(3,6,6-trimethyl-4-oxo(5,6,7-trihydrobenzo[2,1-d]furan-2 -yl))carboxamide
| Molecular Formula | C18H23N3O3 |
|---|---|
| Molecular Weight | 329.17 g/mol |
| LogP | 2.75972 |
| Topological Polar Surface Area | 77.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 329.17395 |
| Heavy Atoms | 24 |
| Complexity | 756.82104 |
Chemical Identifiers
| CAS Number | 832684-25-0 |
|---|---|
| SMILES | CC1=C(OC2=C1C(=O)CC(C2)(C)C)C(=O)NCCCN3C=CN=C3 |
Product Overview
N-[3-(1H-imidazol-1-yl)propyl]-3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide (CAS 832684-25-0), with molecular formula C18H23N3O3 and molecular weight 329.17 g/mol. IUPAC: N-(3-imidazol-1-ylpropyl)-3,6,6-trimethyl-4-oxo-5,7-dihydro-1-benzofuran-2-carboxamide.
Chemical Property Profile of N-[3-(1H-imidazol-1-yl)propyl]-3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide
Property Insights of N-[3-(1H-imidazol-1-yl)propyl]-3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide
The XLogP value of 2.75972 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[3-(1H-imidazol-1-yl)propyl]-3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide. The TPSA of 77.13 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[3-(1H-imidazol-1-yl)propyl]-3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide. Following Lipinski's Rule of Five, N-[3-(1H-imidazol-1-yl)propyl]-3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide 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 N-[3-(1H-imidazol-1-yl)propyl]-3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide?
The CAS number of N-[3-(1H-imidazol-1-yl)propyl]-3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide is 832684-25-0.
What is the molecular formula of N-[3-(1H-imidazol-1-yl)propyl]-3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide?
The molecular formula of N-[3-(1H-imidazol-1-yl)propyl]-3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide is C18H23N3O3.
What is the molecular weight of N-[3-(1H-imidazol-1-yl)propyl]-3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide?
The molecular weight of N-[3-(1H-imidazol-1-yl)propyl]-3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide is 329.17 g/mol.
Where can I buy N-[3-(1H-imidazol-1-yl)propyl]-3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide?
You can request a quote for N-[3-(1H-imidazol-1-yl)propyl]-3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[3-(1H-imidazol-1-yl)propyl]-3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[3-(1H-imidazol-1-yl)propyl]-3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.