3-(1-Benzyl-3-phenylthioureido)propanamide
TL;DR: 3-(1-Benzyl-3-phenylthioureido)propanamide (CAS 371128-52-8) 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.
3-[benzyl(phenylcarbamothioyl)amino]propanamide
Also Known As: 3-(1-benzyl-3-phenylthioureido)propanamide, 3-[benzyl(phenylcarbamothioyl)amino]propanamide, N~3~-benzyl-N~3~-(phenylcarbamothioyl)-beta-alaninamide
| Molecular Formula | C17H19N3OS |
|---|---|
| Molecular Weight | 313.12 g/mol |
| LogP | 2.761 |
| Topological Polar Surface Area | 58.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 313.12488 |
| Heavy Atoms | 22 |
| Complexity | 616.31586 |
Chemical Identifiers
| CAS Number | 371128-52-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN(CCC(=O)N)C(=S)NC2=CC=CC=C2 |
Product Overview
3-(1-Benzyl-3-phenylthioureido)propanamide (CAS 371128-52-8), with molecular formula C17H19N3OS and molecular weight 313.12 g/mol. IUPAC: 3-[benzyl(phenylcarbamothioyl)amino]propanamide.
Chemical Property Profile of 3-(1-Benzyl-3-phenylthioureido)propanamide
Property Insights of 3-(1-Benzyl-3-phenylthioureido)propanamide
The XLogP value of 2.761 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1-Benzyl-3-phenylthioureido)propanamide. With a topological polar surface area (TPSA) of 58.36 Ų, 3-(1-Benzyl-3-phenylthioureido)propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1-Benzyl-3-phenylthioureido)propanamide has 2 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 3-(1-Benzyl-3-phenylthioureido)propanamide?
The CAS number of 3-(1-Benzyl-3-phenylthioureido)propanamide is 371128-52-8.
What is the molecular formula of 3-(1-Benzyl-3-phenylthioureido)propanamide?
The molecular formula of 3-(1-Benzyl-3-phenylthioureido)propanamide is C17H19N3OS.
What is the molecular weight of 3-(1-Benzyl-3-phenylthioureido)propanamide?
The molecular weight of 3-(1-Benzyl-3-phenylthioureido)propanamide is 313.12 g/mol.
Where can I buy 3-(1-Benzyl-3-phenylthioureido)propanamide?
You can request a quote for 3-(1-Benzyl-3-phenylthioureido)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1-Benzyl-3-phenylthioureido)propanamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(1-Benzyl-3-phenylthioureido)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.