![5-(4-chlorophenyl)-6-(3-nitrophenyl)-7-phenyl-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one structure](/static/products/714/714287-35-1.png)
5-(4-chlorophenyl)-6-(3-nitrophenyl)-7-phenyl-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one
TL;DR: 5-(4-chlorophenyl)-6-(3-nitrophenyl)-7-phenyl-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one (CAS 714287-35-1) is a chemical compound with molecular formula C25H19ClN4O3 and molecular weight 458.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-chlorophenyl)-6-(3-nitrophenyl)-7-phenyl-1,2,3,6-tetrahydropyrrolo[3,4-e][1,4]diazepin-8-one
Also Known As: 5-(4-chlorophenyl)-6-(3-nitrophenyl)-7-phenyl-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one, 2-(4-chlorophenyl)-10-(3-nitrophenyl)-9-phenyl-3,6,9-triazabicyclo[5.3.0]deca-2,11-dien-8-one, 5-(4-chlorophenyl)-6-(3-nitrophenyl)-7-phenyl-1,2,3,6-tetrahydropyrrolo[3,4-e][1,4]diazepin-8-one
| Molecular Formula | C25H19ClN4O3 |
|---|---|
| Molecular Weight | 458.11 g/mol |
| LogP | 4.6827 |
| Topological Polar Surface Area | 87.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 458.11456 |
| Heavy Atoms | 33 |
| Complexity | 1302.7421 |
Chemical Identifiers
| CAS Number | 714287-35-1 |
|---|---|
| SMILES | C1CN=C(C2=C(N1)C(=O)N(C2C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4)C5=CC=C(C=C5)Cl |
Product Overview
5-(4-chlorophenyl)-6-(3-nitrophenyl)-7-phenyl-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one (CAS 714287-35-1), with molecular formula C25H19ClN4O3 and molecular weight 458.11 g/mol. IUPAC: 5-(4-chlorophenyl)-6-(3-nitrophenyl)-7-phenyl-1,2,3,6-tetrahydropyrrolo[3,4-e][1,4]diazepin-8-one.
Chemical Property Profile of 5-(4-chlorophenyl)-6-(3-nitrophenyl)-7-phenyl-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one
Property Insights of 5-(4-chlorophenyl)-6-(3-nitrophenyl)-7-phenyl-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one
The XLogP value of 4.6827 indicates that 5-(4-chlorophenyl)-6-(3-nitrophenyl)-7-phenyl-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(4-chlorophenyl)-6-(3-nitrophenyl)-7-phenyl-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one. Following Lipinski's Rule of Five, 5-(4-chlorophenyl)-6-(3-nitrophenyl)-7-phenyl-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one has 1 hydrogen bond donor(s) and 5 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-(4-chlorophenyl)-6-(3-nitrophenyl)-7-phenyl-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one?
The CAS number of 5-(4-chlorophenyl)-6-(3-nitrophenyl)-7-phenyl-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one is 714287-35-1.
What is the molecular formula of 5-(4-chlorophenyl)-6-(3-nitrophenyl)-7-phenyl-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one?
The molecular formula of 5-(4-chlorophenyl)-6-(3-nitrophenyl)-7-phenyl-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one is C25H19ClN4O3.
What is the molecular weight of 5-(4-chlorophenyl)-6-(3-nitrophenyl)-7-phenyl-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one?
The molecular weight of 5-(4-chlorophenyl)-6-(3-nitrophenyl)-7-phenyl-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one is 458.11 g/mol.
Where can I buy 5-(4-chlorophenyl)-6-(3-nitrophenyl)-7-phenyl-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one?
You can request a quote for 5-(4-chlorophenyl)-6-(3-nitrophenyl)-7-phenyl-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-chlorophenyl)-6-(3-nitrophenyl)-7-phenyl-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-chlorophenyl)-6-(3-nitrophenyl)-7-phenyl-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.