THI015
TL;DR: THI015 (CAS 120570-61-8) is a chemical compound with molecular formula C32H52N6O4S and molecular weight 616.3771 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
bis(N-[2-[4-(2-methylpropyl)phenyl]propyl]-4,5-dihydro-1H-imidazol-2-amine);sulfuric acid
Also Known As: THI015, 2-(2-(p-Isobutylphenyl)propylamino)-2-imidazoline hemisulfate hemihydrate, 4,5-Dihydro-N-(2-(4-(2-methylpropyl)phenyl)propyl)-1H-imidazol-2-amine sulfate hydrate (2:1:1), 1H-Imidazol-2-amine, 4,5-dihydro-N-(2-(4-(2-methylpropyl)phenyl)propyl)-, sulfate, hydrate (2:1:1), N-[2-[4-(2-methylpropyl)phenyl]propyl]-4,5-dihydro-1H-imidazol-2-amine; sulfuric acid
Technical Specifications
| Molecular Formula | C32H52N6O4S |
| Molecular Weight | 616.3771 g/mol |
| XLogP | 4.422 |
| Topological Polar Surface Area (TPSA) | 156.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 616.3771 Da |
| Heavy Atoms | 43 |
| Complexity | 372.0 |
| SMILES | CC(C)CC1=CC=C(C=C1)C(C)CNC2=NCCN2.CC(C)CC1=CC=C(C=C1)C(C)CNC2=NCCN2.OS(=O)(=O)O |
| InChIKey | GYVMDIGLMDOHGU-UHFFFAOYSA-N |
Chemical Property Profile of THI015
Property Insights of THI015
The XLogP value of 4.422 indicates that THI015 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 156.0 Ų indicates high polarity, suggesting THI015 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, THI015 has 6 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of THI015?
The CAS number of THI015 is 120570-61-8.
What is the molecular formula of THI015?
The molecular formula of THI015 is C32H52N6O4S.
What is the molecular weight of THI015?
The molecular weight of THI015 is 616.3771 g/mol.
Where can I buy THI015?
You can request a quote for THI015 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for THI015?
Yes, CoreyChem provides custom synthesis services for THI015 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.