![N-[[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-3-butoxybenzamide structure](/static/products/4284/428494-49-9.webp)
N-[[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-3-butoxybenzamide
TL;DR: N-[[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-3-butoxybenzamide (CAS 428494-49-9) is a chemical compound with molecular formula C26H25N3O3S and molecular weight 459.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-3-butoxybenzamide
Also Known As: N-[[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-3-butoxybenzamide, N-{[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl}-3-butoxybenzamide
| Molecular Formula | C26H25N3O3S |
|---|---|
| Molecular Weight | 459.16 g/mol |
| LogP | 6.10892 |
| Topological Polar Surface Area | 76.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 459.16165 |
| Heavy Atoms | 33 |
| Complexity | 1265.9417 |
Chemical Identifiers
| CAS Number | 428494-49-9 |
|---|---|
| SMILES | CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2C)C3=NC4=CC=CC=C4O3 |
Product Overview
N-[[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-3-butoxybenzamide (CAS 428494-49-9), with molecular formula C26H25N3O3S and molecular weight 459.16 g/mol. IUPAC: N-[[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-3-butoxybenzamide.
Chemical Property Profile of N-[[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-3-butoxybenzamide
Property Insights of N-[[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-3-butoxybenzamide
The XLogP value of 6.10892 indicates that N-[[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-3-butoxybenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.39 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-3-butoxybenzamide. Following Lipinski's Rule of Five, N-[[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-3-butoxybenzamide has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-3-butoxybenzamide?
The CAS number of N-[[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-3-butoxybenzamide is 428494-49-9.
What is the molecular formula of N-[[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-3-butoxybenzamide?
The molecular formula of N-[[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-3-butoxybenzamide is C26H25N3O3S.
What is the molecular weight of N-[[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-3-butoxybenzamide?
The molecular weight of N-[[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-3-butoxybenzamide is 459.16 g/mol.
Where can I buy N-[[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-3-butoxybenzamide?
You can request a quote for N-[[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-3-butoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-3-butoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-3-butoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.