RefChem:1078388
TL;DR: RefChem:1078388 (CAS 164334-96-7) is a chemical compound with molecular formula C14H18N4O and molecular weight 258.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-3-(1H-imidazol-5-ylmethyl)-N'-propan-2-ylbenzenecarboximidamide
Also Known As: 2-Hydroxy-3-(1H-imidazol-4-ylmethyl)-N-(1-methylethyl)benzenecarboximidamide hydrate, Benzenecarboximidamide, 2-hydroxy-3-(1H-imidazol-4-ylmethyl)-N-(1-methylethyl)-, hydrate, 2-hydroxy-3-(1H-imidazol-4-ylmethyl)-N-(1-methylethyl)-benzenecarboximidamide, (6E)-6-[amino-(propan-2-ylamino)methylidene]-2-(1H-imidazol-5-ylmethyl)cyclohexa-2,4-dien-1-one, RefChem:1078388
| Molecular Formula | C14H18N4O |
|---|---|
| Molecular Weight | 258.15 g/mol |
| LogP | 1.8198 |
| Topological Polar Surface Area | 87.29 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 258.14807 |
| Heavy Atoms | 19 |
| Complexity | 573.13684 |
Chemical Identifiers
| CAS Number | 164334-96-7 |
|---|---|
| SMILES | CC(C)N=C(C1=CC=CC(=C1O)CC2=CN=CN2)N |
Product Overview
RefChem:1078388 (CAS 164334-96-7), with molecular formula C14H18N4O and molecular weight 258.15 g/mol. IUPAC: 2-hydroxy-3-(1H-imidazol-5-ylmethyl)-N'-propan-2-ylbenzenecarboximidamide.
Chemical Property Profile of RefChem:1078388
Property Insights of RefChem:1078388
The XLogP value of 1.8198 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1078388. The TPSA of 87.29 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1078388. Following Lipinski's Rule of Five, RefChem:1078388 has 3 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 RefChem:1078388?
The CAS number of RefChem:1078388 is 164334-96-7.
What is the molecular formula of RefChem:1078388?
The molecular formula of RefChem:1078388 is C14H18N4O.
What is the molecular weight of RefChem:1078388?
The molecular weight of RefChem:1078388 is 258.15 g/mol.
Where can I buy RefChem:1078388?
You can request a quote for RefChem:1078388 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1078388?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1078388 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.