![2-Cyclohexyl-4-phenyl-3,3a,4,5-tetrahydropyrrolo[3,4-c][1,5]benzodiazepin-1-one structure](/static/products/7468/7468-51-1.webp)
2-Cyclohexyl-4-phenyl-3,3a,4,5-tetrahydropyrrolo[3,4-c][1,5]benzodiazepin-1-one
TL;DR: 2-Cyclohexyl-4-phenyl-3,3a,4,5-tetrahydropyrrolo[3,4-c][1,5]benzodiazepin-1-one (CAS 7468-51-1) is a chemical compound with molecular formula C23H25N3O and molecular weight 359.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyclohexyl-4-phenyl-3,3a,4,5-tetrahydropyrrolo[3,4-c][1,5]benzodiazepin-1-one
Also Known As: 2-cyclohexyl-4-phenyl-3,3a,4,5-tetrahydropyrrolo[3,4-c][1,5]benzodiazepin-1-one, 2-cyclohexyl-10-phenyl-1,9,10,10a-tetrahydropyrrolo[3,4-b][1,5]benzodiazepin-3(2h)-one
| Molecular Formula | C23H25N3O |
|---|---|
| Molecular Weight | 359.20 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 44.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 359.19977 |
| Heavy Atoms | 27 |
| Complexity | 576.0 |
Chemical Identifiers
| CAS Number | 7468-51-1 |
|---|---|
| SMILES | C1CCC(CC1)N2CC3C(NC4=CC=CC=C4N=C3C2=O)C5=CC=CC=C5 |
| InChIKey | YAPSTEUBGXDQLL-UHFFFAOYSA-N |
Product Overview
2-Cyclohexyl-4-phenyl-3,3a,4,5-tetrahydropyrrolo[3,4-c][1,5]benzodiazepin-1-one (CAS 7468-51-1), with molecular formula C23H25N3O and molecular weight 359.20 g/mol. IUPAC: 2-cyclohexyl-4-phenyl-3,3a,4,5-tetrahydropyrrolo[3,4-c][1,5]benzodiazepin-1-one.
Chemical Property Profile of 2-Cyclohexyl-4-phenyl-3,3a,4,5-tetrahydropyrrolo[3,4-c][1,5]benzodiazepin-1-one
Property Insights of 2-Cyclohexyl-4-phenyl-3,3a,4,5-tetrahydropyrrolo[3,4-c][1,5]benzodiazepin-1-one
The XLogP value of 4.1 indicates that 2-Cyclohexyl-4-phenyl-3,3a,4,5-tetrahydropyrrolo[3,4-c][1,5]benzodiazepin-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.7 Ų, 2-Cyclohexyl-4-phenyl-3,3a,4,5-tetrahydropyrrolo[3,4-c][1,5]benzodiazepin-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Cyclohexyl-4-phenyl-3,3a,4,5-tetrahydropyrrolo[3,4-c][1,5]benzodiazepin-1-one 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 2-Cyclohexyl-4-phenyl-3,3a,4,5-tetrahydropyrrolo[3,4-c][1,5]benzodiazepin-1-one?
The CAS number of 2-Cyclohexyl-4-phenyl-3,3a,4,5-tetrahydropyrrolo[3,4-c][1,5]benzodiazepin-1-one is 7468-51-1.
What is the molecular formula of 2-Cyclohexyl-4-phenyl-3,3a,4,5-tetrahydropyrrolo[3,4-c][1,5]benzodiazepin-1-one?
The molecular formula of 2-Cyclohexyl-4-phenyl-3,3a,4,5-tetrahydropyrrolo[3,4-c][1,5]benzodiazepin-1-one is C23H25N3O.
What is the molecular weight of 2-Cyclohexyl-4-phenyl-3,3a,4,5-tetrahydropyrrolo[3,4-c][1,5]benzodiazepin-1-one?
The molecular weight of 2-Cyclohexyl-4-phenyl-3,3a,4,5-tetrahydropyrrolo[3,4-c][1,5]benzodiazepin-1-one is 359.20 g/mol.
Where can I buy 2-Cyclohexyl-4-phenyl-3,3a,4,5-tetrahydropyrrolo[3,4-c][1,5]benzodiazepin-1-one?
You can request a quote for 2-Cyclohexyl-4-phenyl-3,3a,4,5-tetrahydropyrrolo[3,4-c][1,5]benzodiazepin-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Cyclohexyl-4-phenyl-3,3a,4,5-tetrahydropyrrolo[3,4-c][1,5]benzodiazepin-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Cyclohexyl-4-phenyl-3,3a,4,5-tetrahydropyrrolo[3,4-c][1,5]benzodiazepin-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.