1H-1,5-Benzodiazepine, 2,4-dimethyl-7-nitro-
TL;DR: 1H-1,5-Benzodiazepine, 2,4-dimethyl-7-nitro- (CAS 125910-77-2) is a chemical compound with molecular formula C11H11N3O2 and molecular weight 217.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dimethyl-8-nitro-1H-1,5-benzodiazepine
Also Known As: 2,4-dimethyl-8-nitro-1H-1,5-benzodiazepine, 1H-1,5-Benzodiazepine, 2,4-dimethyl-7-nitro-, 1H-1,5-Benzodiazepine,2,4-dimethyl-7-nitro, 3,5-dimethyl-10-nitro-2,6-diazabicyclo[5.4.0]undeca-3,5,8,10,12-pentaene
| Molecular Formula | C11H11N3O2 |
|---|---|
| Molecular Weight | 217.09 g/mol |
| LogP | 3.0165 |
| Topological Polar Surface Area | 67.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 217.08513 |
| Heavy Atoms | 16 |
| Complexity | 517.961 |
Chemical Identifiers
| CAS Number | 125910-77-2 |
|---|---|
| SMILES | CC1=CC(=NC2=C(N1)C=C(C=C2)[N+](=O)[O-])C |
Product Overview
1H-1,5-Benzodiazepine, 2,4-dimethyl-7-nitro- (CAS 125910-77-2), with molecular formula C11H11N3O2 and molecular weight 217.09 g/mol. IUPAC: 2,4-dimethyl-8-nitro-1H-1,5-benzodiazepine.
Chemical Property Profile of 1H-1,5-Benzodiazepine, 2,4-dimethyl-7-nitro-
Property Insights of 1H-1,5-Benzodiazepine, 2,4-dimethyl-7-nitro-
The XLogP value of 3.0165 indicates that 1H-1,5-Benzodiazepine, 2,4-dimethyl-7-nitro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.53 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-1,5-Benzodiazepine, 2,4-dimethyl-7-nitro-. Following Lipinski's Rule of Five, 1H-1,5-Benzodiazepine, 2,4-dimethyl-7-nitro- has 1 hydrogen bond donor(s) and 4 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 1H-1,5-Benzodiazepine, 2,4-dimethyl-7-nitro-?
The CAS number of 1H-1,5-Benzodiazepine, 2,4-dimethyl-7-nitro- is 125910-77-2.
What is the molecular formula of 1H-1,5-Benzodiazepine, 2,4-dimethyl-7-nitro-?
The molecular formula of 1H-1,5-Benzodiazepine, 2,4-dimethyl-7-nitro- is C11H11N3O2.
What is the molecular weight of 1H-1,5-Benzodiazepine, 2,4-dimethyl-7-nitro-?
The molecular weight of 1H-1,5-Benzodiazepine, 2,4-dimethyl-7-nitro- is 217.09 g/mol.
Where can I buy 1H-1,5-Benzodiazepine, 2,4-dimethyl-7-nitro-?
You can request a quote for 1H-1,5-Benzodiazepine, 2,4-dimethyl-7-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-1,5-Benzodiazepine, 2,4-dimethyl-7-nitro-?
Yes, KEHONG BIO provides custom synthesis services for 1H-1,5-Benzodiazepine, 2,4-dimethyl-7-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.