N-((4-(benzo[d]oxazol-2-yl)-3-hydroxyphenyl)carbamothioyl)benzamide
TL;DR: N-((4-(benzo[d]oxazol-2-yl)-3-hydroxyphenyl)carbamothioyl)benzamide (CAS 443291-23-4) is a chemical compound with molecular formula C21H15N3O3S and molecular weight 389.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(1,3-benzoxazol-2-yl)-3-hydroxyphenyl]carbamothioyl]benzamide
Also Known As: N-((4-(benzo[d]oxazol-2-yl)-3-hydroxyphenyl)carbamothioyl)benzamide, 1-BENZOYL-3-[4-(1,3-BENZOXAZOL-2-YL)-3-HYDROXYPHENYL]THIOUREA, 3-BENZOYL-1-[4-(1,3-BENZOXAZOL-2-YL)-3-HYDROXYPHENYL]THIOUREA, N-{[4-(1,3-benzoxazol-2-yl)-3-hydroxyphenyl]carbamothioyl}benzamide, N-[[4-(3H-1,3-benzoxazol-2-ylidene)-3-oxocyclohexa-1,5-dien-1-yl]carbamothioyl]benzamide
| Molecular Formula | C21H15N3O3S |
|---|---|
| Molecular Weight | 389.08 g/mol |
| LogP | 4.3272 |
| Topological Polar Surface Area | 87.39 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 389.0834 |
| Heavy Atoms | 28 |
| Complexity | 1138.9681 |
Chemical Identifiers
| CAS Number | 443291-23-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)C3=NC4=CC=CC=C4O3)O |
Product Overview
N-((4-(benzo[d]oxazol-2-yl)-3-hydroxyphenyl)carbamothioyl)benzamide (CAS 443291-23-4), with molecular formula C21H15N3O3S and molecular weight 389.08 g/mol. IUPAC: N-[[4-(1,3-benzoxazol-2-yl)-3-hydroxyphenyl]carbamothioyl]benzamide.
Chemical Property Profile of N-((4-(benzo[d]oxazol-2-yl)-3-hydroxyphenyl)carbamothioyl)benzamide
Property Insights of N-((4-(benzo[d]oxazol-2-yl)-3-hydroxyphenyl)carbamothioyl)benzamide
The XLogP value of 4.3272 indicates that N-((4-(benzo[d]oxazol-2-yl)-3-hydroxyphenyl)carbamothioyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.39 Ų falls within the moderate polarity range, balancing permeability and solubility for N-((4-(benzo[d]oxazol-2-yl)-3-hydroxyphenyl)carbamothioyl)benzamide. Following Lipinski's Rule of Five, N-((4-(benzo[d]oxazol-2-yl)-3-hydroxyphenyl)carbamothioyl)benzamide has 3 hydrogen bond donor(s) and 5 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-((4-(benzo[d]oxazol-2-yl)-3-hydroxyphenyl)carbamothioyl)benzamide?
The CAS number of N-((4-(benzo[d]oxazol-2-yl)-3-hydroxyphenyl)carbamothioyl)benzamide is 443291-23-4.
What is the molecular formula of N-((4-(benzo[d]oxazol-2-yl)-3-hydroxyphenyl)carbamothioyl)benzamide?
The molecular formula of N-((4-(benzo[d]oxazol-2-yl)-3-hydroxyphenyl)carbamothioyl)benzamide is C21H15N3O3S.
What is the molecular weight of N-((4-(benzo[d]oxazol-2-yl)-3-hydroxyphenyl)carbamothioyl)benzamide?
The molecular weight of N-((4-(benzo[d]oxazol-2-yl)-3-hydroxyphenyl)carbamothioyl)benzamide is 389.08 g/mol.
Where can I buy N-((4-(benzo[d]oxazol-2-yl)-3-hydroxyphenyl)carbamothioyl)benzamide?
You can request a quote for N-((4-(benzo[d]oxazol-2-yl)-3-hydroxyphenyl)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-((4-(benzo[d]oxazol-2-yl)-3-hydroxyphenyl)carbamothioyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-((4-(benzo[d]oxazol-2-yl)-3-hydroxyphenyl)carbamothioyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.