RefChem:1090976
TL;DR: RefChem:1090976 (CAS 102280-45-5) is a chemical compound with molecular formula C13H17Br2N3 and molecular weight 372.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-bromo-5,6,7,8-tetrahydronaphthalen-1-yl)-(4,5-dihydro-1H-imidazol-2-yl)azanium bromide
Also Known As: 2-Imidazoline, 2-(2-bromo-5,6,7,8-tetrahydro-1-naphthylamino)-, hydrobromide, 1-NAPHTHYLAMINE, 5,6,7,8-TETRAHYDRO-2-BROMO-N-(2-IMIDAZOLIN-2-YL)-, HYDROBROMIDE, 2(or 4)-(Monobromo-5,6,7,8-tetrahydro-1-naphthylamino)-2-imidazoline hydrobromide, (2-bromo-5,6,7,8-tetrahydronaphthalen-1-yl)-(4,5-dihydro-1H-imidazol-2-yl)azanium bromide, n-(2-bromo-5,6,7,8-tetrahydronaphthalen-1-yl)-4,5-dihydro-1h-imidazol-2-aminium bromide
| Molecular Formula | C13H17Br2N3 |
|---|---|
| Molecular Weight | 372.98 g/mol |
| LogP | -1.51 |
| Topological Polar Surface Area | 41.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 374.97687 |
| Heavy Atoms | 18 |
| Complexity | 305.0 |
Chemical Identifiers
| CAS Number | 102280-45-5 |
|---|---|
| SMILES | C1CCC2=C(C1)C=CC(=C2[NH2+]C3=NCCN3)Br.[Br-] |
| InChIKey | LZCFRJUNARAKLE-UHFFFAOYSA-N |
Product Overview
RefChem:1090976 (CAS 102280-45-5), with molecular formula C13H17Br2N3 and molecular weight 372.98 g/mol. IUPAC: (2-bromo-5,6,7,8-tetrahydronaphthalen-1-yl)-(4,5-dihydro-1H-imidazol-2-yl)azanium bromide.
Chemical Property Profile of RefChem:1090976
Property Insights of RefChem:1090976
The XLogP value of -1.51 indicates that RefChem:1090976 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 41.0 Ų, RefChem:1090976 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1090976 has 2 hydrogen bond donor(s) and 2 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:1090976?
The CAS number of RefChem:1090976 is 102280-45-5.
What is the molecular formula of RefChem:1090976?
The molecular formula of RefChem:1090976 is C13H17Br2N3.
What is the molecular weight of RefChem:1090976?
The molecular weight of RefChem:1090976 is 372.98 g/mol.
Where can I buy RefChem:1090976?
You can request a quote for RefChem:1090976 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1090976?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1090976 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.