![N-((3-(benzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-4-(sec-butoxy)benzamide structure](/static/products/532/532418-90-9.png)
N-((3-(benzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-4-(sec-butoxy)benzamide
TL;DR: N-((3-(benzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-4-(sec-butoxy)benzamide (CAS 532418-90-9) is a chemical compound with molecular formula C25H23N3O4S and molecular weight 461.14 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)-4-hydroxyphenyl]carbamothioyl]-4-butan-2-yloxybenzamide
Also Known As: N-((3-(benzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-4-(sec-butoxy)benzamide, N-{[3-(1,3-benzoxazol-2-yl)-4-hydroxyphenyl]carbamothioyl}-4-(butan-2-yloxy)benzamide, N-[[(3E)-3-(3H-1,3-benzoxazol-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]carbamothioyl]-4-butan-2-yloxybenzamide, N-[[3-(3H-1,3-benzoxazol-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]carbamothioyl]-4-butan-2-yloxybenzamide
| Molecular Formula | C25H23N3O4S |
|---|---|
| Molecular Weight | 461.14 g/mol |
| LogP | 5.5045 |
| Topological Polar Surface Area | 96.62 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 461.14093 |
| Heavy Atoms | 33 |
| Complexity | 1267.7633 |
Chemical Identifiers
| CAS Number | 532418-90-9 |
|---|---|
| SMILES | CCC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)O)C3=NC4=CC=CC=C4O3 |
Product Overview
N-((3-(benzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-4-(sec-butoxy)benzamide (CAS 532418-90-9), with molecular formula C25H23N3O4S and molecular weight 461.14 g/mol. IUPAC: N-[[3-(1,3-benzoxazol-2-yl)-4-hydroxyphenyl]carbamothioyl]-4-butan-2-yloxybenzamide.
Chemical Property Profile of N-((3-(benzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-4-(sec-butoxy)benzamide
Property Insights of N-((3-(benzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-4-(sec-butoxy)benzamide
The XLogP value of 5.5045 indicates that N-((3-(benzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-4-(sec-butoxy)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.62 Ų falls within the moderate polarity range, balancing permeability and solubility for N-((3-(benzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-4-(sec-butoxy)benzamide. Following Lipinski's Rule of Five, N-((3-(benzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-4-(sec-butoxy)benzamide has 3 hydrogen bond donor(s) and 6 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-(benzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-4-(sec-butoxy)benzamide?
The CAS number of N-((3-(benzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-4-(sec-butoxy)benzamide is 532418-90-9.
What is the molecular formula of N-((3-(benzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-4-(sec-butoxy)benzamide?
The molecular formula of N-((3-(benzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-4-(sec-butoxy)benzamide is C25H23N3O4S.
What is the molecular weight of N-((3-(benzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-4-(sec-butoxy)benzamide?
The molecular weight of N-((3-(benzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-4-(sec-butoxy)benzamide is 461.14 g/mol.
Where can I buy N-((3-(benzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-4-(sec-butoxy)benzamide?
You can request a quote for N-((3-(benzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-4-(sec-butoxy)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-((3-(benzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-4-(sec-butoxy)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-((3-(benzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-4-(sec-butoxy)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.