N-methyl-4-nitro-2,1,3-benzoxadiazol-5-amine
TL;DR: N-methyl-4-nitro-2,1,3-benzoxadiazol-5-amine (CAS 18378-30-8) is a chemical compound with molecular formula C7H6N4O3 and molecular weight 194.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-4-nitro-2,1,3-benzoxadiazol-5-amine
Also Known As: N-methyl-4-nitro-2,1,3-benzoxadiazol-5-amine
| Molecular Formula | C7H6N4O3 |
|---|---|
| Molecular Weight | 194.04 g/mol |
| LogP | 1.1727 |
| Topological Polar Surface Area | 94.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 194.04399 |
| Heavy Atoms | 14 |
| Complexity | 492.6406 |
Chemical Identifiers
| CAS Number | 18378-30-8 |
|---|---|
| SMILES | CNC1=C(C2=NON=C2C=C1)[N+](=O)[O-] |
Product Overview
N-methyl-4-nitro-2,1,3-benzoxadiazol-5-amine (CAS 18378-30-8), with molecular formula C7H6N4O3 and molecular weight 194.04 g/mol. IUPAC: N-methyl-4-nitro-2,1,3-benzoxadiazol-5-amine.
Chemical Property Profile of N-methyl-4-nitro-2,1,3-benzoxadiazol-5-amine
Property Insights of N-methyl-4-nitro-2,1,3-benzoxadiazol-5-amine
The XLogP value of 1.1727 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-methyl-4-nitro-2,1,3-benzoxadiazol-5-amine. The TPSA of 94.09 Ų falls within the moderate polarity range, balancing permeability and solubility for N-methyl-4-nitro-2,1,3-benzoxadiazol-5-amine. Following Lipinski's Rule of Five, N-methyl-4-nitro-2,1,3-benzoxadiazol-5-amine 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 N-methyl-4-nitro-2,1,3-benzoxadiazol-5-amine?
The CAS number of N-methyl-4-nitro-2,1,3-benzoxadiazol-5-amine is 18378-30-8.
What is the molecular formula of N-methyl-4-nitro-2,1,3-benzoxadiazol-5-amine?
The molecular formula of N-methyl-4-nitro-2,1,3-benzoxadiazol-5-amine is C7H6N4O3.
What is the molecular weight of N-methyl-4-nitro-2,1,3-benzoxadiazol-5-amine?
The molecular weight of N-methyl-4-nitro-2,1,3-benzoxadiazol-5-amine is 194.04 g/mol.
Where can I buy N-methyl-4-nitro-2,1,3-benzoxadiazol-5-amine?
You can request a quote for N-methyl-4-nitro-2,1,3-benzoxadiazol-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-methyl-4-nitro-2,1,3-benzoxadiazol-5-amine?
Yes, KEHONG BIO provides custom synthesis services for N-methyl-4-nitro-2,1,3-benzoxadiazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.