Isonaamine B
TL;DR: Isonaamine B (CAS 203116-58-9) is a chemical compound with molecular formula C19H21N3O2 and molecular weight 323.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[2-imino-4-[(4-methoxyphenyl)methyl]-3-methylimidazol-1-yl]methyl]phenol
Also Known As: Isonaamine B, 4-[[2-imino-4-[(4-methoxyphenyl)methyl]-3-methylimidazol-1-yl]methyl]phenol, 4-((2-imino-4-((4-methoxyphenyl)methyl)-3-methylimidazol-1-yl)methyl)phenol, 4-[[[2-Imino-2,3-dihydro-3-methyl-4-(4-methoxybenzyl)-1H-imidazol]-1-yl]methyl]phenol, 4-[[2-imino-4-[(4-methoxyphenyl)methyl]-3-methyl-imidazol-1-yl]methyl]phenol
| Molecular Formula | C19H21N3O2 |
|---|---|
| Molecular Weight | 323.16 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 59.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 323.1634 |
| Heavy Atoms | 24 |
| Complexity | 463.0 |
Chemical Identifiers
| CAS Number | 203116-58-9 |
|---|---|
| SMILES | CN1C(=CN(C1=N)CC2=CC=C(C=C2)O)CC3=CC=C(C=C3)OC |
| InChIKey | JIBAGYXFZSHPGG-UHFFFAOYSA-N |
Product Overview
Isonaamine B (CAS 203116-58-9), with molecular formula C19H21N3O2 and molecular weight 323.16 g/mol. IUPAC: 4-[[2-imino-4-[(4-methoxyphenyl)methyl]-3-methylimidazol-1-yl]methyl]phenol.
Chemical Property Profile of Isonaamine B
Property Insights of Isonaamine B
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isonaamine B. With a topological polar surface area (TPSA) of 59.8 Ų, Isonaamine B exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isonaamine B has 2 hydrogen bond donor(s) and 3 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 Isonaamine B?
The CAS number of Isonaamine B is 203116-58-9.
What is the molecular formula of Isonaamine B?
The molecular formula of Isonaamine B is C19H21N3O2.
What is the molecular weight of Isonaamine B?
The molecular weight of Isonaamine B is 323.16 g/mol.
Where can I buy Isonaamine B?
You can request a quote for Isonaamine B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isonaamine B?
Yes, KEHONG BIO provides custom synthesis services for Isonaamine B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.