Pseudourea, 3-benzyl-2-phenyl-, hydrochloride
TL;DR: Pseudourea, 3-benzyl-2-phenyl-, hydrochloride (CAS 73839-95-9) is a chemical compound with molecular formula C14H15ClN2S and molecular weight 278.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl N'-benzylcarbamimidothioate;hydrochloride
Also Known As: 3-Benzyl-2-phenylpseudourea hydrochloride, Pseudourea, 3-benzyl-2-phenyl-, hydrochloride, phenyl N'-benzylcarbamimidothioate hydrochloride, Phenyl N'-benzylcarbamimidothioate--hydrogen chloride (1/1), Carbamimidothioic acid, (phenylmethyl)-, phenyl ester, monohydrochloride
| Molecular Formula | C14H15ClN2S |
|---|---|
| Molecular Weight | 278.06 g/mol |
| LogP | 3.7154 |
| Topological Polar Surface Area | 38.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 278.06445 |
| Heavy Atoms | 18 |
| Complexity | 485.6619 |
Chemical Identifiers
| CAS Number | 73839-95-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN=C(N)SC2=CC=CC=C2.Cl |
Product Overview
Pseudourea, 3-benzyl-2-phenyl-, hydrochloride (CAS 73839-95-9), with molecular formula C14H15ClN2S and molecular weight 278.06 g/mol. IUPAC: phenyl N'-benzylcarbamimidothioate;hydrochloride.
Chemical Property Profile of Pseudourea, 3-benzyl-2-phenyl-, hydrochloride
Property Insights of Pseudourea, 3-benzyl-2-phenyl-, hydrochloride
The XLogP value of 3.7154 indicates that Pseudourea, 3-benzyl-2-phenyl-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.38 Ų, Pseudourea, 3-benzyl-2-phenyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pseudourea, 3-benzyl-2-phenyl-, 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
Frequently Asked Questions
What is the CAS number of Pseudourea, 3-benzyl-2-phenyl-, hydrochloride?
The CAS number of Pseudourea, 3-benzyl-2-phenyl-, hydrochloride is 73839-95-9.
What is the molecular formula of Pseudourea, 3-benzyl-2-phenyl-, hydrochloride?
The molecular formula of Pseudourea, 3-benzyl-2-phenyl-, hydrochloride is C14H15ClN2S.
What is the molecular weight of Pseudourea, 3-benzyl-2-phenyl-, hydrochloride?
The molecular weight of Pseudourea, 3-benzyl-2-phenyl-, hydrochloride is 278.06 g/mol.
Where can I buy Pseudourea, 3-benzyl-2-phenyl-, hydrochloride?
You can request a quote for Pseudourea, 3-benzyl-2-phenyl-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pseudourea, 3-benzyl-2-phenyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Pseudourea, 3-benzyl-2-phenyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.