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N-[(2-bromophenyl)carbamothioyl]-3-phenylpropanamide
TL;DR: N-[(2-bromophenyl)carbamothioyl]-3-phenylpropanamide (CAS 651706-97-7) is a chemical compound with molecular formula C16H15BrN2OS and molecular weight 362.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-bromophenyl)carbamothioyl]-3-phenylpropanamide
Also Known As: N-[(2-bromophenyl)carbamothioyl]-3-phenylpropanamide, N-{[(2-bromophenyl)amino]carbonothioyl}-3-phenylpropanamide, AN-329/42174006, N-(2-bromophenyl)-N'-(3-phenylpropanoyl)thiourea, N-(2-Bromophenyl)-N/'-(3-phenylpropanoyl)thiourea
| Molecular Formula | C16H15BrN2OS |
|---|---|
| Molecular Weight | 362.01 g/mol |
| LogP | 3.8949 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 362.00885 |
| Heavy Atoms | 21 |
| Complexity | 631.1839 |
Chemical Identifiers
| CAS Number | 651706-97-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCC(=O)NC(=S)NC2=CC=CC=C2Br |
Product Overview
N-[(2-bromophenyl)carbamothioyl]-3-phenylpropanamide (CAS 651706-97-7), with molecular formula C16H15BrN2OS and molecular weight 362.01 g/mol. IUPAC: N-[(2-bromophenyl)carbamothioyl]-3-phenylpropanamide.
Chemical Property Profile of N-[(2-bromophenyl)carbamothioyl]-3-phenylpropanamide
Property Insights of N-[(2-bromophenyl)carbamothioyl]-3-phenylpropanamide
The XLogP value of 3.8949 indicates that N-[(2-bromophenyl)carbamothioyl]-3-phenylpropanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, N-[(2-bromophenyl)carbamothioyl]-3-phenylpropanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(2-bromophenyl)carbamothioyl]-3-phenylpropanamide 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 N-[(2-bromophenyl)carbamothioyl]-3-phenylpropanamide?
The CAS number of N-[(2-bromophenyl)carbamothioyl]-3-phenylpropanamide is 651706-97-7.
What is the molecular formula of N-[(2-bromophenyl)carbamothioyl]-3-phenylpropanamide?
The molecular formula of N-[(2-bromophenyl)carbamothioyl]-3-phenylpropanamide is C16H15BrN2OS.
What is the molecular weight of N-[(2-bromophenyl)carbamothioyl]-3-phenylpropanamide?
The molecular weight of N-[(2-bromophenyl)carbamothioyl]-3-phenylpropanamide is 362.01 g/mol.
Where can I buy N-[(2-bromophenyl)carbamothioyl]-3-phenylpropanamide?
You can request a quote for N-[(2-bromophenyl)carbamothioyl]-3-phenylpropanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(2-bromophenyl)carbamothioyl]-3-phenylpropanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(2-bromophenyl)carbamothioyl]-3-phenylpropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.