Benzyl N-benzylcarbamimidothioate--hydrogen chloride (1/1)
TL;DR: Benzyl N-benzylcarbamimidothioate--hydrogen chloride (1/1) (CAS 73840-00-3) is a chemical compound with molecular formula C15H17ClN2S and molecular weight 292.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl N'-benzylcarbamimidothioate;hydrochloride
Also Known As: 2,3-Dibenzylpseudourea hydrochloride, Pseudourea, 2,3-dibenzyl-, hydrochloride, benzyl N'-benzylcarbamimidothioate hydrochloride, Benzyl N-benzylcarbamimidothioate--hydrogen chloride (1/1), Carbamimidothioic acid, (phenylmethyl)-, phenylmethyl ester, monohydrochloride
| Molecular Formula | C15H17ClN2S |
|---|---|
| Molecular Weight | 292.08 g/mol |
| LogP | 3.8565 |
| Topological Polar Surface Area | 38.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 292.0801 |
| Heavy Atoms | 19 |
| Complexity | 500.06873 |
Chemical Identifiers
| CAS Number | 73840-00-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN=C(N)SCC2=CC=CC=C2.Cl |
Product Overview
Benzyl N-benzylcarbamimidothioate--hydrogen chloride (1/1) (CAS 73840-00-3), with molecular formula C15H17ClN2S and molecular weight 292.08 g/mol. IUPAC: benzyl N'-benzylcarbamimidothioate;hydrochloride.
Chemical Property Profile of Benzyl N-benzylcarbamimidothioate--hydrogen chloride (1/1)
Property Insights of Benzyl N-benzylcarbamimidothioate--hydrogen chloride (1/1)
The XLogP value of 3.8565 indicates that Benzyl N-benzylcarbamimidothioate--hydrogen chloride (1/1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.38 Ų, Benzyl N-benzylcarbamimidothioate--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl N-benzylcarbamimidothioate--hydrogen chloride (1/1) 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
Frequently Asked Questions
What is the CAS number of Benzyl N-benzylcarbamimidothioate--hydrogen chloride (1/1)?
The CAS number of Benzyl N-benzylcarbamimidothioate--hydrogen chloride (1/1) is 73840-00-3.
What is the molecular formula of Benzyl N-benzylcarbamimidothioate--hydrogen chloride (1/1)?
The molecular formula of Benzyl N-benzylcarbamimidothioate--hydrogen chloride (1/1) is C15H17ClN2S.
What is the molecular weight of Benzyl N-benzylcarbamimidothioate--hydrogen chloride (1/1)?
The molecular weight of Benzyl N-benzylcarbamimidothioate--hydrogen chloride (1/1) is 292.08 g/mol.
Where can I buy Benzyl N-benzylcarbamimidothioate--hydrogen chloride (1/1)?
You can request a quote for Benzyl N-benzylcarbamimidothioate--hydrogen chloride (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl N-benzylcarbamimidothioate--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for Benzyl N-benzylcarbamimidothioate--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.