1-Acetamido-3-(2-chloro-3-phenylpropyl)thiourea
TL;DR: 1-Acetamido-3-(2-chloro-3-phenylpropyl)thiourea (CAS 391890-98-5) is a chemical compound with molecular formula C12H16ClN3OS and molecular weight 285.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-acetamido-3-(2-chloro-3-phenylpropyl)thiourea
Also Known As: 1-acetamido-3-(2-chloro-3-phenylpropyl)thiourea, N-{[(2-chloro-3-phenylpropyl)carbamothioyl]amino}acetamide, 2-acetyl-N-(2-chloro-3-phenylpropyl)hydrazinecarbothioamide, F0762-0397
| Molecular Formula | C12H16ClN3OS |
|---|---|
| Molecular Weight | 285.07 g/mol |
| LogP | 1.3517 |
| Topological Polar Surface Area | 53.16 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 285.07025 |
| Heavy Atoms | 18 |
| Complexity | 399.56882 |
Chemical Identifiers
| CAS Number | 391890-98-5 |
|---|---|
| SMILES | CC(=O)NNC(=S)NCC(CC1=CC=CC=C1)Cl |
Product Overview
1-Acetamido-3-(2-chloro-3-phenylpropyl)thiourea (CAS 391890-98-5), with molecular formula C12H16ClN3OS and molecular weight 285.07 g/mol. IUPAC: 1-acetamido-3-(2-chloro-3-phenylpropyl)thiourea.
Chemical Property Profile of 1-Acetamido-3-(2-chloro-3-phenylpropyl)thiourea
Property Insights of 1-Acetamido-3-(2-chloro-3-phenylpropyl)thiourea
The XLogP value of 1.3517 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Acetamido-3-(2-chloro-3-phenylpropyl)thiourea. With a topological polar surface area (TPSA) of 53.16 Ų, 1-Acetamido-3-(2-chloro-3-phenylpropyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Acetamido-3-(2-chloro-3-phenylpropyl)thiourea has 3 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 1-Acetamido-3-(2-chloro-3-phenylpropyl)thiourea?
The CAS number of 1-Acetamido-3-(2-chloro-3-phenylpropyl)thiourea is 391890-98-5.
What is the molecular formula of 1-Acetamido-3-(2-chloro-3-phenylpropyl)thiourea?
The molecular formula of 1-Acetamido-3-(2-chloro-3-phenylpropyl)thiourea is C12H16ClN3OS.
What is the molecular weight of 1-Acetamido-3-(2-chloro-3-phenylpropyl)thiourea?
The molecular weight of 1-Acetamido-3-(2-chloro-3-phenylpropyl)thiourea is 285.07 g/mol.
Where can I buy 1-Acetamido-3-(2-chloro-3-phenylpropyl)thiourea?
You can request a quote for 1-Acetamido-3-(2-chloro-3-phenylpropyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Acetamido-3-(2-chloro-3-phenylpropyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-Acetamido-3-(2-chloro-3-phenylpropyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.