![5-benzyl-3,7,7-trimethyl-1-phenyl-7,8-dihydropyrazolo[4,3-c]azepine-4,6(1H,5H)-dione structure](/static/products/302/302588-77-8.png)
5-benzyl-3,7,7-trimethyl-1-phenyl-7,8-dihydropyrazolo[4,3-c]azepine-4,6(1H,5H)-dione
TL;DR: 5-benzyl-3,7,7-trimethyl-1-phenyl-7,8-dihydropyrazolo[4,3-c]azepine-4,6(1H,5H)-dione (CAS 302588-77-8) is a chemical compound with molecular formula C23H23N3O2 and molecular weight 373.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-benzyl-3,7,7-trimethyl-1-phenyl-8H-pyrazolo[4,5-c]azepine-4,6-dione
Also Known As: 5-benzyl-3,7,7-trimethyl-1-phenyl-7,8-dihydropyrazolo[4,3-c]azepine-4,6(1H,5H)-dione, 5-benzyl-3,7,7-trimethyl-1-phenyl-8H-pyrazolo[4,3-c]azepine-4,6-dione, 3,7,7-trimethyl-1-phenyl-5-benzyl-8H-pyrazolo[5,4-e]azepine-4,6-dione, 5-Benzyl-3,7,7-trimethyl-1-phenyl-7,8-dihydro-1H-1,2,5-triaza-azulene-4,6-dione
| Molecular Formula | C23H23N3O2 |
|---|---|
| Molecular Weight | 373.18 g/mol |
| LogP | 3.93202 |
| Topological Polar Surface Area | 55.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 373.17902 |
| Heavy Atoms | 28 |
| Complexity | 1036.4692 |
Chemical Identifiers
| CAS Number | 302588-77-8 |
|---|---|
| SMILES | CC1=NN(C2=C1C(=O)N(C(=O)C(C2)(C)C)CC3=CC=CC=C3)C4=CC=CC=C4 |
Product Overview
5-benzyl-3,7,7-trimethyl-1-phenyl-7,8-dihydropyrazolo[4,3-c]azepine-4,6(1H,5H)-dione (CAS 302588-77-8), with molecular formula C23H23N3O2 and molecular weight 373.18 g/mol. IUPAC: 5-benzyl-3,7,7-trimethyl-1-phenyl-8H-pyrazolo[4,5-c]azepine-4,6-dione.
Chemical Property Profile of 5-benzyl-3,7,7-trimethyl-1-phenyl-7,8-dihydropyrazolo[4,3-c]azepine-4,6(1H,5H)-dione
Property Insights of 5-benzyl-3,7,7-trimethyl-1-phenyl-7,8-dihydropyrazolo[4,3-c]azepine-4,6(1H,5H)-dione
The XLogP value of 3.93202 indicates that 5-benzyl-3,7,7-trimethyl-1-phenyl-7,8-dihydropyrazolo[4,3-c]azepine-4,6(1H,5H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.2 Ų, 5-benzyl-3,7,7-trimethyl-1-phenyl-7,8-dihydropyrazolo[4,3-c]azepine-4,6(1H,5H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-benzyl-3,7,7-trimethyl-1-phenyl-7,8-dihydropyrazolo[4,3-c]azepine-4,6(1H,5H)-dione 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 5-benzyl-3,7,7-trimethyl-1-phenyl-7,8-dihydropyrazolo[4,3-c]azepine-4,6(1H,5H)-dione?
The CAS number of 5-benzyl-3,7,7-trimethyl-1-phenyl-7,8-dihydropyrazolo[4,3-c]azepine-4,6(1H,5H)-dione is 302588-77-8.
What is the molecular formula of 5-benzyl-3,7,7-trimethyl-1-phenyl-7,8-dihydropyrazolo[4,3-c]azepine-4,6(1H,5H)-dione?
The molecular formula of 5-benzyl-3,7,7-trimethyl-1-phenyl-7,8-dihydropyrazolo[4,3-c]azepine-4,6(1H,5H)-dione is C23H23N3O2.
What is the molecular weight of 5-benzyl-3,7,7-trimethyl-1-phenyl-7,8-dihydropyrazolo[4,3-c]azepine-4,6(1H,5H)-dione?
The molecular weight of 5-benzyl-3,7,7-trimethyl-1-phenyl-7,8-dihydropyrazolo[4,3-c]azepine-4,6(1H,5H)-dione is 373.18 g/mol.
Where can I buy 5-benzyl-3,7,7-trimethyl-1-phenyl-7,8-dihydropyrazolo[4,3-c]azepine-4,6(1H,5H)-dione?
You can request a quote for 5-benzyl-3,7,7-trimethyl-1-phenyl-7,8-dihydropyrazolo[4,3-c]azepine-4,6(1H,5H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-benzyl-3,7,7-trimethyl-1-phenyl-7,8-dihydropyrazolo[4,3-c]azepine-4,6(1H,5H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-benzyl-3,7,7-trimethyl-1-phenyl-7,8-dihydropyrazolo[4,3-c]azepine-4,6(1H,5H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.