3-((N-Propan-3-ol-N-imidazolin-2-ylamino)methyl)indole hydroiodide
TL;DR: 3-((N-Propan-3-ol-N-imidazolin-2-ylamino)methyl)indole hydroiodide (CAS 77587-69-0) is a chemical compound with molecular formula C15H21IN4O and molecular weight 400.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4,5-dihydro-1H-imidazol-2-yl(1H-indol-3-ylmethyl)amino]propan-1-ol;hydroiodide
Also Known As: 3-((N-Propan-3-ol-N-imidazolin-2-ylamino)methyl)indole hydroiodide, 1-Propanol, 3-((4,5-dihydro-1H-imidazol-2-yl)(1H-indol-3-ylmethyl)amino)-, monohydroiodide, 3-((4,5-Dihydro-1H-imidazol-2-yl)(1H-indol-3-ylmethyl)amino)-1-propanol monohydroiodide, 3-[4,5-dihydro-1H-imidazol-2-yl(1H-indol-3-ylmethyl)amino]propan-1-ol hydroiodide, 3-{(4,5-Dihydro-1H-imidazol-2-yl)[(1H-indol-3-yl)methyl]amino}propan-1-ol--hydrogen iodide (1/1)
| Molecular Formula | C15H21IN4O |
|---|---|
| Molecular Weight | 400.08 g/mol |
| LogP | 1.9295 |
| Topological Polar Surface Area | 63.65 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 400.07602 |
| Heavy Atoms | 21 |
| Complexity | 610.4943 |
Chemical Identifiers
| CAS Number | 77587-69-0 |
|---|---|
| SMILES | C1CN=C(N1)N(CCCO)CC2=CNC3=CC=CC=C32.I |
Product Overview
3-((N-Propan-3-ol-N-imidazolin-2-ylamino)methyl)indole hydroiodide (CAS 77587-69-0), with molecular formula C15H21IN4O and molecular weight 400.08 g/mol. IUPAC: 3-[4,5-dihydro-1H-imidazol-2-yl(1H-indol-3-ylmethyl)amino]propan-1-ol;hydroiodide.
Chemical Property Profile of 3-((N-Propan-3-ol-N-imidazolin-2-ylamino)methyl)indole hydroiodide
Property Insights of 3-((N-Propan-3-ol-N-imidazolin-2-ylamino)methyl)indole hydroiodide
The XLogP value of 1.9295 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-((N-Propan-3-ol-N-imidazolin-2-ylamino)methyl)indole hydroiodide. The TPSA of 63.65 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-((N-Propan-3-ol-N-imidazolin-2-ylamino)methyl)indole hydroiodide. Following Lipinski's Rule of Five, 3-((N-Propan-3-ol-N-imidazolin-2-ylamino)methyl)indole hydroiodide has 3 hydrogen bond donor(s) and 4 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-((N-Propan-3-ol-N-imidazolin-2-ylamino)methyl)indole hydroiodide?
The CAS number of 3-((N-Propan-3-ol-N-imidazolin-2-ylamino)methyl)indole hydroiodide is 77587-69-0.
What is the molecular formula of 3-((N-Propan-3-ol-N-imidazolin-2-ylamino)methyl)indole hydroiodide?
The molecular formula of 3-((N-Propan-3-ol-N-imidazolin-2-ylamino)methyl)indole hydroiodide is C15H21IN4O.
What is the molecular weight of 3-((N-Propan-3-ol-N-imidazolin-2-ylamino)methyl)indole hydroiodide?
The molecular weight of 3-((N-Propan-3-ol-N-imidazolin-2-ylamino)methyl)indole hydroiodide is 400.08 g/mol.
Where can I buy 3-((N-Propan-3-ol-N-imidazolin-2-ylamino)methyl)indole hydroiodide?
You can request a quote for 3-((N-Propan-3-ol-N-imidazolin-2-ylamino)methyl)indole hydroiodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((N-Propan-3-ol-N-imidazolin-2-ylamino)methyl)indole hydroiodide?
Yes, KEHONG BIO provides custom synthesis services for 3-((N-Propan-3-ol-N-imidazolin-2-ylamino)methyl)indole hydroiodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.