![3-methoxy-N-[(5-methyl-1H-imidazole-4-carbonyl)amino]benzene structure](/static/products/900/90017-05-3.png)
3-methoxy-N-[(5-methyl-1H-imidazole-4-carbonyl)amino]benzene
TL;DR: 3-methoxy-N-[(5-methyl-1H-imidazole-4-carbonyl)amino]benzene (CAS 90017-05-3) is a chemical compound with molecular formula C14H13N5O2 and molecular weight 283.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methoxy-N-[(5-methyl-1H-imidazole-4-carbonyl)amino]benzenecarboximidoyl cyanide
Also Known As: 3-methoxy-N-[(5-methyl-1H-imidazole-4-carbonyl)amino]benzene, 3-methoxy-N-[(5-methyl-1H-imidazole-4-carbonyl)amino]benzenecarboximidoyl cyanide, N'-[Cyano(3-methoxyphenyl)methylidene]-5-methyl-1H-imidazole-4-carbohydrazide, N-[[CYANO-(3-METHOXYPHENYL)METHYLIDENE]AMINO]-5-METHYL-1H-IMIDAZOLE-4-CARBOXAMIDE
| Molecular Formula | C14H13N5O2 |
|---|---|
| Molecular Weight | 283.11 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 283.10693 |
| Heavy Atoms | 21 |
| Complexity | 456.0 |
Chemical Identifiers
| CAS Number | 90017-05-3 |
|---|---|
| SMILES | CC1=C(N=CN1)C(=O)NN=C(C#N)C2=CC(=CC=C2)OC |
| InChIKey | AVSZARSFPHJLRA-UHFFFAOYSA-N |
Product Overview
3-methoxy-N-[(5-methyl-1H-imidazole-4-carbonyl)amino]benzene (CAS 90017-05-3), with molecular formula C14H13N5O2 and molecular weight 283.11 g/mol. IUPAC: 3-methoxy-N-[(5-methyl-1H-imidazole-4-carbonyl)amino]benzenecarboximidoyl cyanide.
Chemical Property Profile of 3-methoxy-N-[(5-methyl-1H-imidazole-4-carbonyl)amino]benzene
Property Insights of 3-methoxy-N-[(5-methyl-1H-imidazole-4-carbonyl)amino]benzene
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-methoxy-N-[(5-methyl-1H-imidazole-4-carbonyl)amino]benzene. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-methoxy-N-[(5-methyl-1H-imidazole-4-carbonyl)amino]benzene. Following Lipinski's Rule of Five, 3-methoxy-N-[(5-methyl-1H-imidazole-4-carbonyl)amino]benzene has 2 hydrogen bond donor(s) and 5 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 3-methoxy-N-[(5-methyl-1H-imidazole-4-carbonyl)amino]benzene?
The CAS number of 3-methoxy-N-[(5-methyl-1H-imidazole-4-carbonyl)amino]benzene is 90017-05-3.
What is the molecular formula of 3-methoxy-N-[(5-methyl-1H-imidazole-4-carbonyl)amino]benzene?
The molecular formula of 3-methoxy-N-[(5-methyl-1H-imidazole-4-carbonyl)amino]benzene is C14H13N5O2.
What is the molecular weight of 3-methoxy-N-[(5-methyl-1H-imidazole-4-carbonyl)amino]benzene?
The molecular weight of 3-methoxy-N-[(5-methyl-1H-imidazole-4-carbonyl)amino]benzene is 283.11 g/mol.
Where can I buy 3-methoxy-N-[(5-methyl-1H-imidazole-4-carbonyl)amino]benzene?
You can request a quote for 3-methoxy-N-[(5-methyl-1H-imidazole-4-carbonyl)amino]benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-methoxy-N-[(5-methyl-1H-imidazole-4-carbonyl)amino]benzene?
Yes, KEHONG BIO provides custom synthesis services for 3-methoxy-N-[(5-methyl-1H-imidazole-4-carbonyl)amino]benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.