(2-Benzamido-3-phenylpropyl) carbamimidothioate
TL;DR: (2-Benzamido-3-phenylpropyl) carbamimidothioate (CAS 69321-44-4) is a chemical compound with molecular formula C17H19N3OS and molecular weight 313.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-benzamido-3-phenylpropyl) carbamimidothioate
Also Known As: (2-benzamido-3-phenylpropyl) carbamimidothioate, N-(1-carbamimidoylsulfanyl-3-phenyl-propan-2-yl)benzamide
| Molecular Formula | C17H19N3OS |
|---|---|
| Molecular Weight | 313.12 g/mol |
| LogP | 2.65437 |
| Topological Polar Surface Area | 78.97 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 313.12488 |
| Heavy Atoms | 22 |
| Complexity | 616.31586 |
Chemical Identifiers
| CAS Number | 69321-44-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(CSC(=N)N)NC(=O)C2=CC=CC=C2 |
Product Overview
(2-Benzamido-3-phenylpropyl) carbamimidothioate (CAS 69321-44-4), with molecular formula C17H19N3OS and molecular weight 313.12 g/mol. IUPAC: (2-benzamido-3-phenylpropyl) carbamimidothioate.
Chemical Property Profile of (2-Benzamido-3-phenylpropyl) carbamimidothioate
Property Insights of (2-Benzamido-3-phenylpropyl) carbamimidothioate
The XLogP value of 2.65437 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-Benzamido-3-phenylpropyl) carbamimidothioate. The TPSA of 78.97 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-Benzamido-3-phenylpropyl) carbamimidothioate. Following Lipinski's Rule of Five, (2-Benzamido-3-phenylpropyl) carbamimidothioate has 3 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 (2-Benzamido-3-phenylpropyl) carbamimidothioate?
The CAS number of (2-Benzamido-3-phenylpropyl) carbamimidothioate is 69321-44-4.
What is the molecular formula of (2-Benzamido-3-phenylpropyl) carbamimidothioate?
The molecular formula of (2-Benzamido-3-phenylpropyl) carbamimidothioate is C17H19N3OS.
What is the molecular weight of (2-Benzamido-3-phenylpropyl) carbamimidothioate?
The molecular weight of (2-Benzamido-3-phenylpropyl) carbamimidothioate is 313.12 g/mol.
Where can I buy (2-Benzamido-3-phenylpropyl) carbamimidothioate?
You can request a quote for (2-Benzamido-3-phenylpropyl) carbamimidothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Benzamido-3-phenylpropyl) carbamimidothioate?
Yes, KEHONG BIO provides custom synthesis services for (2-Benzamido-3-phenylpropyl) carbamimidothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.