4-Benzofurazanamine, 7-nitro-N-propyl-
TL;DR: 4-Benzofurazanamine, 7-nitro-N-propyl- (CAS 54517-98-5) is a chemical compound with molecular formula C9H10N4O3 and molecular weight 222.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-nitro-N-propyl-2,1,3-benzoxadiazol-7-amine
Also Known As: 4-Benzofurazanamine, 7-nitro-N-propyl-, 4-Propylamino-7-nitrobenzofurazane, 4-nitro-N-propyl-2,1,3-benzoxadiazol-7-amine, 7-Nitro-n-propyl-2,1,3-benzoxadiazol-4-amine, 2,1,3-Benzoxadiazol-4-amine, 7-nitro-N-propyl-
| Molecular Formula | C9H10N4O3 |
|---|---|
| Molecular Weight | 222.08 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 96.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 222.07529 |
| Heavy Atoms | 16 |
| Complexity | 258.0 |
Chemical Identifiers
| CAS Number | 54517-98-5 |
|---|---|
| SMILES | CCCNC1=CC=C(C2=NON=C12)[N+](=O)[O-] |
| InChIKey | YVWDSXHBXWTADD-UHFFFAOYSA-N |
Product Overview
4-Benzofurazanamine, 7-nitro-N-propyl- (CAS 54517-98-5), with molecular formula C9H10N4O3 and molecular weight 222.08 g/mol. IUPAC: 4-nitro-N-propyl-2,1,3-benzoxadiazol-7-amine.
Chemical Property Profile of 4-Benzofurazanamine, 7-nitro-N-propyl-
Property Insights of 4-Benzofurazanamine, 7-nitro-N-propyl-
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Benzofurazanamine, 7-nitro-N-propyl-. The TPSA of 96.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Benzofurazanamine, 7-nitro-N-propyl-. Following Lipinski's Rule of Five, 4-Benzofurazanamine, 7-nitro-N-propyl- has 1 hydrogen bond donor(s) and 6 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-Benzofurazanamine, 7-nitro-N-propyl-?
The CAS number of 4-Benzofurazanamine, 7-nitro-N-propyl- is 54517-98-5.
What is the molecular formula of 4-Benzofurazanamine, 7-nitro-N-propyl-?
The molecular formula of 4-Benzofurazanamine, 7-nitro-N-propyl- is C9H10N4O3.
What is the molecular weight of 4-Benzofurazanamine, 7-nitro-N-propyl-?
The molecular weight of 4-Benzofurazanamine, 7-nitro-N-propyl- is 222.08 g/mol.
Where can I buy 4-Benzofurazanamine, 7-nitro-N-propyl-?
You can request a quote for 4-Benzofurazanamine, 7-nitro-N-propyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Benzofurazanamine, 7-nitro-N-propyl-?
Yes, KEHONG BIO provides custom synthesis services for 4-Benzofurazanamine, 7-nitro-N-propyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.