Hydantoin, 5-benzyl-3-(3-(dimethylamino)propyl)-2-thio-, hydrochloride
TL;DR: Hydantoin, 5-benzyl-3-(3-(dimethylamino)propyl)-2-thio-, hydrochloride (CAS 86503-29-9) is a chemical compound with molecular formula C15H22ClN3OS and molecular weight 327.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-benzyl-3-[3-(dimethylamino)propyl]-2-sulfanylideneimidazolidin-4-one;hydrochloride
Also Known As: 5-Benzyl-3-(3-(dimethylamino)propyl)-2-thiohydantoin hydrochloride, Hydantoin, 5-benzyl-3-(3-(dimethylamino)propyl)-2-thio-, hydrochloride, 4-Imidazolidinone, 3-(3-(dimethylamino)propyl)-5-(phenylmethyl)-2-thioxo-, HCl, (+-)-, 5-benzyl-3-[3-(dimethylamino)propyl]-2-sulfanylideneimidazolidin-4-one hydrochloride, 5-Benzyl-3-[3-(dimethylamino)propyl]-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one--hydrogen chloride (1/1)
| Molecular Formula | C15H22ClN3OS |
|---|---|
| Molecular Weight | 327.12 g/mol |
| LogP | 1.6879 |
| Topological Polar Surface Area | 35.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 327.11722 |
| Heavy Atoms | 21 |
| Complexity | 481.0669 |
Chemical Identifiers
| CAS Number | 86503-29-9 |
|---|---|
| SMILES | CN(C)CCCN1C(=O)C(NC1=S)CC2=CC=CC=C2.Cl |
Product Overview
Hydantoin, 5-benzyl-3-(3-(dimethylamino)propyl)-2-thio-, hydrochloride (CAS 86503-29-9), with molecular formula C15H22ClN3OS and molecular weight 327.12 g/mol. IUPAC: 5-benzyl-3-[3-(dimethylamino)propyl]-2-sulfanylideneimidazolidin-4-one;hydrochloride.
Chemical Property Profile of Hydantoin, 5-benzyl-3-(3-(dimethylamino)propyl)-2-thio-, hydrochloride
Property Insights of Hydantoin, 5-benzyl-3-(3-(dimethylamino)propyl)-2-thio-, hydrochloride
The XLogP value of 1.6879 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hydantoin, 5-benzyl-3-(3-(dimethylamino)propyl)-2-thio-, hydrochloride. With a topological polar surface area (TPSA) of 35.58 Ų, Hydantoin, 5-benzyl-3-(3-(dimethylamino)propyl)-2-thio-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hydantoin, 5-benzyl-3-(3-(dimethylamino)propyl)-2-thio-, hydrochloride has 1 hydrogen bond donor(s) and 3 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 Hydantoin, 5-benzyl-3-(3-(dimethylamino)propyl)-2-thio-, hydrochloride?
The CAS number of Hydantoin, 5-benzyl-3-(3-(dimethylamino)propyl)-2-thio-, hydrochloride is 86503-29-9.
What is the molecular formula of Hydantoin, 5-benzyl-3-(3-(dimethylamino)propyl)-2-thio-, hydrochloride?
The molecular formula of Hydantoin, 5-benzyl-3-(3-(dimethylamino)propyl)-2-thio-, hydrochloride is C15H22ClN3OS.
What is the molecular weight of Hydantoin, 5-benzyl-3-(3-(dimethylamino)propyl)-2-thio-, hydrochloride?
The molecular weight of Hydantoin, 5-benzyl-3-(3-(dimethylamino)propyl)-2-thio-, hydrochloride is 327.12 g/mol.
Where can I buy Hydantoin, 5-benzyl-3-(3-(dimethylamino)propyl)-2-thio-, hydrochloride?
You can request a quote for Hydantoin, 5-benzyl-3-(3-(dimethylamino)propyl)-2-thio-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hydantoin, 5-benzyl-3-(3-(dimethylamino)propyl)-2-thio-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Hydantoin, 5-benzyl-3-(3-(dimethylamino)propyl)-2-thio-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.