N-(((1S,2S)-1-hydroxy-1-phenylpropan-2-yl)(methyl)carbamothioyl)benzamide
TL;DR: N-(((1S,2S)-1-hydroxy-1-phenylpropan-2-yl)(methyl)carbamothioyl)benzamide (CAS 457049-94-4) is a chemical compound with molecular formula C18H20N2O2S and molecular weight 328.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[(1S,2S)-1-hydroxy-1-phenylpropan-2-yl]-methylcarbamothioyl]benzamide
Also Known As: N-(((1S,2S)-1-hydroxy-1-phenylpropan-2-yl)(methyl)carbamothioyl)benzamide, N-[[(1S,2S)-1-hydroxy-1-phenylpropan-2-yl]-methylcarbamothioyl]benzamide
| Molecular Formula | C18H20N2O2S |
|---|---|
| Molecular Weight | 328.12 g/mol |
| LogP | 2.7552 |
| Topological Polar Surface Area | 52.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 328.12454 |
| Heavy Atoms | 23 |
| Complexity | 661.2365 |
Chemical Identifiers
| CAS Number | 457049-94-4 |
|---|---|
| SMILES | C[C@@H]([C@H](C1=CC=CC=C1)O)N(C)C(=S)NC(=O)C2=CC=CC=C2 |
Product Overview
N-(((1S,2S)-1-hydroxy-1-phenylpropan-2-yl)(methyl)carbamothioyl)benzamide (CAS 457049-94-4), with molecular formula C18H20N2O2S and molecular weight 328.12 g/mol. IUPAC: N-[[(1S,2S)-1-hydroxy-1-phenylpropan-2-yl]-methylcarbamothioyl]benzamide.
Chemical Property Profile of N-(((1S,2S)-1-hydroxy-1-phenylpropan-2-yl)(methyl)carbamothioyl)benzamide
Property Insights of N-(((1S,2S)-1-hydroxy-1-phenylpropan-2-yl)(methyl)carbamothioyl)benzamide
The XLogP value of 2.7552 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(((1S,2S)-1-hydroxy-1-phenylpropan-2-yl)(methyl)carbamothioyl)benzamide. With a topological polar surface area (TPSA) of 52.57 Ų, N-(((1S,2S)-1-hydroxy-1-phenylpropan-2-yl)(methyl)carbamothioyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(((1S,2S)-1-hydroxy-1-phenylpropan-2-yl)(methyl)carbamothioyl)benzamide has 2 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 N-(((1S,2S)-1-hydroxy-1-phenylpropan-2-yl)(methyl)carbamothioyl)benzamide?
The CAS number of N-(((1S,2S)-1-hydroxy-1-phenylpropan-2-yl)(methyl)carbamothioyl)benzamide is 457049-94-4.
What is the molecular formula of N-(((1S,2S)-1-hydroxy-1-phenylpropan-2-yl)(methyl)carbamothioyl)benzamide?
The molecular formula of N-(((1S,2S)-1-hydroxy-1-phenylpropan-2-yl)(methyl)carbamothioyl)benzamide is C18H20N2O2S.
What is the molecular weight of N-(((1S,2S)-1-hydroxy-1-phenylpropan-2-yl)(methyl)carbamothioyl)benzamide?
The molecular weight of N-(((1S,2S)-1-hydroxy-1-phenylpropan-2-yl)(methyl)carbamothioyl)benzamide is 328.12 g/mol.
Where can I buy N-(((1S,2S)-1-hydroxy-1-phenylpropan-2-yl)(methyl)carbamothioyl)benzamide?
You can request a quote for N-(((1S,2S)-1-hydroxy-1-phenylpropan-2-yl)(methyl)carbamothioyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(((1S,2S)-1-hydroxy-1-phenylpropan-2-yl)(methyl)carbamothioyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(((1S,2S)-1-hydroxy-1-phenylpropan-2-yl)(methyl)carbamothioyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.