N-((3-(5,6-dimethylbenzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-3-methoxy-2-naphthamide
TL;DR: N-((3-(5,6-dimethylbenzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-3-methoxy-2-naphthamide (CAS 530128-31-5) is a chemical compound with molecular formula C28H23N3O4S and molecular weight 497.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[3-(5,6-dimethyl-1,3-benzoxazol-2-yl)-4-hydroxyphenyl]carbamothioyl]-3-methoxynaphthalene-2-carboxamide
Also Known As: N-((3-(5,6-dimethylbenzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-3-methoxy-2-naphthamide, N-({[3-(5,6-dimethylbenzoxazol-2-yl)-4-hydroxyphenyl]amino}thioxomethyl)(3-met hoxy(2-naphthyl))carboxamide, N-[[(3E)-3-(5,6-dimethyl-3H-1,3-benzoxazol-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]carbamothioyl]-3-methoxynaphthalene-2-carboxamide, N-[[3-(5,6-dimethyl-3H-1,3-benzoxazol-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]carbamothioyl]-3-methoxynaphthalene-2-carboxamide, N-{[3-(5,6-dimethyl-1,3-benzoxazol-2-yl)-4-hydroxyphenyl]carbamothioyl}-3-methoxynaphthalene-2-carboxamide
| Molecular Formula | C28H23N3O4S |
|---|---|
| Molecular Weight | 497.14 g/mol |
| LogP | 6.10584 |
| Topological Polar Surface Area | 96.62 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 497.14093 |
| Heavy Atoms | 36 |
| Complexity | 1619.3268 |
Chemical Identifiers
| CAS Number | 530128-31-5 |
|---|---|
| SMILES | CC1=CC2=C(C=C1C)OC(=N2)C3=C(C=CC(=C3)NC(=S)NC(=O)C4=CC5=CC=CC=C5C=C4OC)O |
Product Overview
N-((3-(5,6-dimethylbenzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-3-methoxy-2-naphthamide (CAS 530128-31-5), with molecular formula C28H23N3O4S and molecular weight 497.14 g/mol. IUPAC: N-[[3-(5,6-dimethyl-1,3-benzoxazol-2-yl)-4-hydroxyphenyl]carbamothioyl]-3-methoxynaphthalene-2-carboxamide.
Chemical Property Profile of N-((3-(5,6-dimethylbenzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-3-methoxy-2-naphthamide
Property Insights of N-((3-(5,6-dimethylbenzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-3-methoxy-2-naphthamide
The XLogP value of 6.10584 indicates that N-((3-(5,6-dimethylbenzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-3-methoxy-2-naphthamide 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-(5,6-dimethylbenzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-3-methoxy-2-naphthamide. Following Lipinski's Rule of Five, N-((3-(5,6-dimethylbenzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-3-methoxy-2-naphthamide 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-(5,6-dimethylbenzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-3-methoxy-2-naphthamide?
The CAS number of N-((3-(5,6-dimethylbenzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-3-methoxy-2-naphthamide is 530128-31-5.
What is the molecular formula of N-((3-(5,6-dimethylbenzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-3-methoxy-2-naphthamide?
The molecular formula of N-((3-(5,6-dimethylbenzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-3-methoxy-2-naphthamide is C28H23N3O4S.
What is the molecular weight of N-((3-(5,6-dimethylbenzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-3-methoxy-2-naphthamide?
The molecular weight of N-((3-(5,6-dimethylbenzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-3-methoxy-2-naphthamide is 497.14 g/mol.
Where can I buy N-((3-(5,6-dimethylbenzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-3-methoxy-2-naphthamide?
You can request a quote for N-((3-(5,6-dimethylbenzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-3-methoxy-2-naphthamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-((3-(5,6-dimethylbenzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-3-methoxy-2-naphthamide?
Yes, KEHONG BIO provides custom synthesis services for N-((3-(5,6-dimethylbenzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-3-methoxy-2-naphthamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.