1,4-dimethyl-3,5-dihydro-2H-1,4-benzodiazepine
TL;DR: 1,4-dimethyl-3,5-dihydro-2H-1,4-benzodiazepine (CAS 442519-36-0) is a chemical compound with molecular formula C11H16N2 and molecular weight 176.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dimethyl-3,5-dihydro-2H-1,4-benzodiazepine
Also Known As: J1.744.280E, 1,4-dimethyl-3,5-dihydro-2H-1,4-benzodiazepine, 1,4-dimethyl-2,3,4,5-tetrahydro-1H-benzo[e][1,4]diazepine, 1,4-Dimethyl-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine, 3,6-dimethyl-3,6-diazabicyclo[5.4.0]undeca-7,9,11-triene
| Molecular Formula | C11H16N2 |
|---|---|
| Molecular Weight | 176.13 g/mol |
| LogP | 1.5682 |
| Topological Polar Surface Area | 6.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 176.13135 |
| Heavy Atoms | 13 |
| Complexity | 295.89667 |
Chemical Identifiers
| CAS Number | 442519-36-0 |
|---|---|
| SMILES | CN1CCN(C2=CC=CC=C2C1)C |
Product Overview
1,4-dimethyl-3,5-dihydro-2H-1,4-benzodiazepine (CAS 442519-36-0), with molecular formula C11H16N2 and molecular weight 176.13 g/mol. IUPAC: 1,4-dimethyl-3,5-dihydro-2H-1,4-benzodiazepine.
Chemical Property Profile of 1,4-dimethyl-3,5-dihydro-2H-1,4-benzodiazepine
Property Insights of 1,4-dimethyl-3,5-dihydro-2H-1,4-benzodiazepine
The XLogP value of 1.5682 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-dimethyl-3,5-dihydro-2H-1,4-benzodiazepine. With a topological polar surface area (TPSA) of 6.48 Ų, 1,4-dimethyl-3,5-dihydro-2H-1,4-benzodiazepine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-dimethyl-3,5-dihydro-2H-1,4-benzodiazepine has 0 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 1,4-dimethyl-3,5-dihydro-2H-1,4-benzodiazepine?
The CAS number of 1,4-dimethyl-3,5-dihydro-2H-1,4-benzodiazepine is 442519-36-0.
What is the molecular formula of 1,4-dimethyl-3,5-dihydro-2H-1,4-benzodiazepine?
The molecular formula of 1,4-dimethyl-3,5-dihydro-2H-1,4-benzodiazepine is C11H16N2.
What is the molecular weight of 1,4-dimethyl-3,5-dihydro-2H-1,4-benzodiazepine?
The molecular weight of 1,4-dimethyl-3,5-dihydro-2H-1,4-benzodiazepine is 176.13 g/mol.
Where can I buy 1,4-dimethyl-3,5-dihydro-2H-1,4-benzodiazepine?
You can request a quote for 1,4-dimethyl-3,5-dihydro-2H-1,4-benzodiazepine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-dimethyl-3,5-dihydro-2H-1,4-benzodiazepine?
Yes, KEHONG BIO provides custom synthesis services for 1,4-dimethyl-3,5-dihydro-2H-1,4-benzodiazepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.