4,7-dimethyl-2-phenyl-1H-1,5-benzodiazepine
TL;DR: 4,7-dimethyl-2-phenyl-1H-1,5-benzodiazepine (CAS 324031-58-5) is a chemical compound with molecular formula C17H16N2 and molecular weight 248.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,8-dimethyl-4-phenyl-1H-1,5-benzodiazepine
Also Known As: 4,7-dimethyl-2-phenyl-1H-1,5-benzodiazepine, BAS 00366278, 2,8-dimethyl-4-phenyl-1H-1,5-benzodiazepine, BIM-0022578.P001, 4,7-Dimethyl-2-phenyl-1H-benzo[b][1,4]diazepine
| Molecular Formula | C17H16N2 |
|---|---|
| Molecular Weight | 248.13 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 24.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 248.13135 |
| Heavy Atoms | 19 |
| Complexity | 377.0 |
Chemical Identifiers
| CAS Number | 324031-58-5 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N=C(C=C(N2)C)C3=CC=CC=C3 |
| InChIKey | XNGGBOVUGMQDFI-UHFFFAOYSA-N |
Product Overview
4,7-dimethyl-2-phenyl-1H-1,5-benzodiazepine (CAS 324031-58-5), with molecular formula C17H16N2 and molecular weight 248.13 g/mol. IUPAC: 2,8-dimethyl-4-phenyl-1H-1,5-benzodiazepine.
Chemical Property Profile of 4,7-dimethyl-2-phenyl-1H-1,5-benzodiazepine
Property Insights of 4,7-dimethyl-2-phenyl-1H-1,5-benzodiazepine
The XLogP value of 3.9 indicates that 4,7-dimethyl-2-phenyl-1H-1,5-benzodiazepine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.4 Ų, 4,7-dimethyl-2-phenyl-1H-1,5-benzodiazepine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,7-dimethyl-2-phenyl-1H-1,5-benzodiazepine has 1 hydrogen bond donor(s) and 2 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 4,7-dimethyl-2-phenyl-1H-1,5-benzodiazepine?
The CAS number of 4,7-dimethyl-2-phenyl-1H-1,5-benzodiazepine is 324031-58-5.
What is the molecular formula of 4,7-dimethyl-2-phenyl-1H-1,5-benzodiazepine?
The molecular formula of 4,7-dimethyl-2-phenyl-1H-1,5-benzodiazepine is C17H16N2.
What is the molecular weight of 4,7-dimethyl-2-phenyl-1H-1,5-benzodiazepine?
The molecular weight of 4,7-dimethyl-2-phenyl-1H-1,5-benzodiazepine is 248.13 g/mol.
Where can I buy 4,7-dimethyl-2-phenyl-1H-1,5-benzodiazepine?
You can request a quote for 4,7-dimethyl-2-phenyl-1H-1,5-benzodiazepine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,7-dimethyl-2-phenyl-1H-1,5-benzodiazepine?
Yes, KEHONG BIO provides custom synthesis services for 4,7-dimethyl-2-phenyl-1H-1,5-benzodiazepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.