3-(3-(Dimethylamino)propyl)-5-(5-imidazolylmethyl)-2-thiohydantoin dihydrochloride
TL;DR: 3-(3-(Dimethylamino)propyl)-5-(5-imidazolylmethyl)-2-thiohydantoin dihydrochloride (CAS 86503-34-6) is a chemical compound with molecular formula C12H21Cl2N5OS and molecular weight 353.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-(dimethylamino)propyl]-5-(1H-imidazol-5-ylmethyl)-2-sulfanylideneimidazolidin-4-one;dihydrochloride
Also Known As: 3-(3-(Dimethylamino)propyl)-5-(5-imidazolylmethyl)-2-thiohydantoin dihydrochloride, Hydantoin, 3-(3-(dimethylamino)propyl)-5-(5-imidazolylmethyl)-2-thio-, dihydrochloride, 3-[3-(dimethylamino)propyl]-5-(1H-imidazol-5-ylmethyl)-2-sulfanylideneimidazolidin-4-one dihydrochloride, 3-[3-(Dimethylamino)propyl]-5-[(1H-imidazol-5-yl)methyl]-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one--hydrogen chloride (1/2), RefChem:347906
| Molecular Formula | C12H21Cl2N5OS |
|---|---|
| Molecular Weight | 353.08 g/mol |
| LogP | 0.8328 |
| Topological Polar Surface Area | 64.26 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 353.08438 |
| Heavy Atoms | 21 |
| Complexity | 454.51007 |
Chemical Identifiers
| CAS Number | 86503-34-6 |
|---|---|
| SMILES | CN(C)CCCN1C(=O)C(NC1=S)CC2=CN=CN2.Cl.Cl |
Product Overview
3-(3-(Dimethylamino)propyl)-5-(5-imidazolylmethyl)-2-thiohydantoin dihydrochloride (CAS 86503-34-6), with molecular formula C12H21Cl2N5OS and molecular weight 353.08 g/mol. IUPAC: 3-[3-(dimethylamino)propyl]-5-(1H-imidazol-5-ylmethyl)-2-sulfanylideneimidazolidin-4-one;dihydrochloride.
Chemical Property Profile of 3-(3-(Dimethylamino)propyl)-5-(5-imidazolylmethyl)-2-thiohydantoin dihydrochloride
Property Insights of 3-(3-(Dimethylamino)propyl)-5-(5-imidazolylmethyl)-2-thiohydantoin dihydrochloride
The XLogP value of 0.8328 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3-(Dimethylamino)propyl)-5-(5-imidazolylmethyl)-2-thiohydantoin dihydrochloride. The TPSA of 64.26 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3-(Dimethylamino)propyl)-5-(5-imidazolylmethyl)-2-thiohydantoin dihydrochloride. Following Lipinski's Rule of Five, 3-(3-(Dimethylamino)propyl)-5-(5-imidazolylmethyl)-2-thiohydantoin dihydrochloride has 2 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-(3-(Dimethylamino)propyl)-5-(5-imidazolylmethyl)-2-thiohydantoin dihydrochloride?
The CAS number of 3-(3-(Dimethylamino)propyl)-5-(5-imidazolylmethyl)-2-thiohydantoin dihydrochloride is 86503-34-6.
What is the molecular formula of 3-(3-(Dimethylamino)propyl)-5-(5-imidazolylmethyl)-2-thiohydantoin dihydrochloride?
The molecular formula of 3-(3-(Dimethylamino)propyl)-5-(5-imidazolylmethyl)-2-thiohydantoin dihydrochloride is C12H21Cl2N5OS.
What is the molecular weight of 3-(3-(Dimethylamino)propyl)-5-(5-imidazolylmethyl)-2-thiohydantoin dihydrochloride?
The molecular weight of 3-(3-(Dimethylamino)propyl)-5-(5-imidazolylmethyl)-2-thiohydantoin dihydrochloride is 353.08 g/mol.
Where can I buy 3-(3-(Dimethylamino)propyl)-5-(5-imidazolylmethyl)-2-thiohydantoin dihydrochloride?
You can request a quote for 3-(3-(Dimethylamino)propyl)-5-(5-imidazolylmethyl)-2-thiohydantoin dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-(Dimethylamino)propyl)-5-(5-imidazolylmethyl)-2-thiohydantoin dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-(Dimethylamino)propyl)-5-(5-imidazolylmethyl)-2-thiohydantoin dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.