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N-[(2-hydroxyphenyl)carbamothioyl]-4-propan-2-ylbenzamide
TL;DR: N-[(2-hydroxyphenyl)carbamothioyl]-4-propan-2-ylbenzamide (CAS 428856-95-5) is a chemical compound with molecular formula C17H18N2O2S and molecular weight 314.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-hydroxyphenyl)carbamothioyl]-4-propan-2-ylbenzamide
Also Known As: AB00111351-01, N-[(2-hydroxyphenyl)carbamothioyl]-4-propan-2-ylbenzamide, N-[(2-hydroxyphenyl)carbamothioyl]-4-(propan-2-yl)benzamide
| Molecular Formula | C17H18N2O2S |
|---|---|
| Molecular Weight | 314.11 g/mol |
| LogP | 3.6424 |
| Topological Polar Surface Area | 61.36 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 314.1089 |
| Heavy Atoms | 22 |
| Complexity | 681.31323 |
Chemical Identifiers
| CAS Number | 428856-95-5 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2O |
Product Overview
N-[(2-hydroxyphenyl)carbamothioyl]-4-propan-2-ylbenzamide (CAS 428856-95-5), with molecular formula C17H18N2O2S and molecular weight 314.11 g/mol. IUPAC: N-[(2-hydroxyphenyl)carbamothioyl]-4-propan-2-ylbenzamide.
Chemical Property Profile of N-[(2-hydroxyphenyl)carbamothioyl]-4-propan-2-ylbenzamide
Property Insights of N-[(2-hydroxyphenyl)carbamothioyl]-4-propan-2-ylbenzamide
The XLogP value of 3.6424 indicates that N-[(2-hydroxyphenyl)carbamothioyl]-4-propan-2-ylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.36 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(2-hydroxyphenyl)carbamothioyl]-4-propan-2-ylbenzamide. Following Lipinski's Rule of Five, N-[(2-hydroxyphenyl)carbamothioyl]-4-propan-2-ylbenzamide 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 N-[(2-hydroxyphenyl)carbamothioyl]-4-propan-2-ylbenzamide?
The CAS number of N-[(2-hydroxyphenyl)carbamothioyl]-4-propan-2-ylbenzamide is 428856-95-5.
What is the molecular formula of N-[(2-hydroxyphenyl)carbamothioyl]-4-propan-2-ylbenzamide?
The molecular formula of N-[(2-hydroxyphenyl)carbamothioyl]-4-propan-2-ylbenzamide is C17H18N2O2S.
What is the molecular weight of N-[(2-hydroxyphenyl)carbamothioyl]-4-propan-2-ylbenzamide?
The molecular weight of N-[(2-hydroxyphenyl)carbamothioyl]-4-propan-2-ylbenzamide is 314.11 g/mol.
Where can I buy N-[(2-hydroxyphenyl)carbamothioyl]-4-propan-2-ylbenzamide?
You can request a quote for N-[(2-hydroxyphenyl)carbamothioyl]-4-propan-2-ylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(2-hydroxyphenyl)carbamothioyl]-4-propan-2-ylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(2-hydroxyphenyl)carbamothioyl]-4-propan-2-ylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.