7-chloro-N,N-diethyl-4-nitro-2,1,3-benzoxadiazol-5-amine
TL;DR: 7-chloro-N,N-diethyl-4-nitro-2,1,3-benzoxadiazol-5-amine (CAS 1217634-00-8) is a chemical compound with molecular formula C10H11ClN4O3 and molecular weight 270.05197 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-chloro-N,N-diethyl-4-nitro-2,1,3-benzoxadiazol-5-amine
Also Known As: 7-chloro-N,N-diethyl-4-nitro-2,1,3-benzoxadiazol-5-amine, 7-Chloro-N,N-diethyl-4-nitrobenzo[c][1,2,5]oxadiazol-5-amine, 7-Chloro-5-(N,N-diethylamino)-4-nitrobenzofurazan, I01-14204, 2,1,3-Benzoxadiazol-5-amine,7-chloro-N,N-diethyl-4-nitro-
Technical Specifications
| Molecular Formula | C10H11ClN4O3 |
| Molecular Weight | 270.05197 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 88.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 270.05197 Da |
| Heavy Atoms | 18 |
| Complexity | 310.0 |
| SMILES | CCN(CC)C1=C(C2=NON=C2C(=C1)Cl)[N+](=O)[O-] |
| InChIKey | OXXZTIXFMCJHEJ-UHFFFAOYSA-N |
Chemical Property Profile of 7-chloro-N,N-diethyl-4-nitro-2,1,3-benzoxadiazol-5-amine
Property Insights of 7-chloro-N,N-diethyl-4-nitro-2,1,3-benzoxadiazol-5-amine
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-chloro-N,N-diethyl-4-nitro-2,1,3-benzoxadiazol-5-amine. The TPSA of 88.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-chloro-N,N-diethyl-4-nitro-2,1,3-benzoxadiazol-5-amine. Following Lipinski's Rule of Five, 7-chloro-N,N-diethyl-4-nitro-2,1,3-benzoxadiazol-5-amine has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 7-chloro-N,N-diethyl-4-nitro-2,1,3-benzoxadiazol-5-amine?
The CAS number of 7-chloro-N,N-diethyl-4-nitro-2,1,3-benzoxadiazol-5-amine is 1217634-00-8.
What is the molecular formula of 7-chloro-N,N-diethyl-4-nitro-2,1,3-benzoxadiazol-5-amine?
The molecular formula of 7-chloro-N,N-diethyl-4-nitro-2,1,3-benzoxadiazol-5-amine is C10H11ClN4O3.
What is the molecular weight of 7-chloro-N,N-diethyl-4-nitro-2,1,3-benzoxadiazol-5-amine?
The molecular weight of 7-chloro-N,N-diethyl-4-nitro-2,1,3-benzoxadiazol-5-amine is 270.05197 g/mol.
Where can I buy 7-chloro-N,N-diethyl-4-nitro-2,1,3-benzoxadiazol-5-amine?
You can request a quote for 7-chloro-N,N-diethyl-4-nitro-2,1,3-benzoxadiazol-5-amine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 7-chloro-N,N-diethyl-4-nitro-2,1,3-benzoxadiazol-5-amine?
Yes, CoreyChem provides custom synthesis services for 7-chloro-N,N-diethyl-4-nitro-2,1,3-benzoxadiazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.