2-Isopropoxybutanohydrazide hydrochloride
TL;DR: 2-Isopropoxybutanohydrazide hydrochloride (CAS 1049749-98-5) is a chemical compound with molecular formula C16H10Cl2N2OS and molecular weight 347.98907 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[(2,4-dichlorophenyl)methylidene]-3-phenyl-2-sulfanylideneimidazolidin-4-one
Also Known As: 2-Isopropoxybutanohydrazide hydrochloride, (5E)-5-(2,4-dichlorobenzylidene)-2-mercapto-3-phenyl-3,5-dihydro-4H-imidazol-4-one, 5-[(2,4-dichlorophenyl)methylidene]-3-phenyl-2-sulfanylideneimidazolidin-4-one, (5Z)-5-[(2,4-dichlorophenyl)methylidene]-3-phenyl-2-sulfanylideneimidazolidin-4-one
Technical Specifications
| Molecular Formula | C16H10Cl2N2OS |
| Molecular Weight | 347.98907 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 64.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 347.98907 Da |
| Heavy Atoms | 22 |
| Complexity | 491.0 |
| SMILES | C1=CC=C(C=C1)N2C(=O)C(=CC3=C(C=C(C=C3)Cl)Cl)NC2=S |
| InChIKey | DDMANRIXEMHHCM-UHFFFAOYSA-N |
Chemical Property Profile of 2-Isopropoxybutanohydrazide hydrochloride
Property Insights of 2-Isopropoxybutanohydrazide hydrochloride
The XLogP value of 4.7 indicates that 2-Isopropoxybutanohydrazide hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Isopropoxybutanohydrazide hydrochloride. Following Lipinski's Rule of Five, 2-Isopropoxybutanohydrazide hydrochloride has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Isopropoxybutanohydrazide hydrochloride?
The CAS number of 2-Isopropoxybutanohydrazide hydrochloride is 1049749-98-5.
What is the molecular formula of 2-Isopropoxybutanohydrazide hydrochloride?
The molecular formula of 2-Isopropoxybutanohydrazide hydrochloride is C16H10Cl2N2OS.
What is the molecular weight of 2-Isopropoxybutanohydrazide hydrochloride?
The molecular weight of 2-Isopropoxybutanohydrazide hydrochloride is 347.98907 g/mol.
Where can I buy 2-Isopropoxybutanohydrazide hydrochloride?
You can request a quote for 2-Isopropoxybutanohydrazide hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Isopropoxybutanohydrazide hydrochloride?
Yes, CoreyChem provides custom synthesis services for 2-Isopropoxybutanohydrazide hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.