![(5-bromonaphthyl)-N-({[2-(4-fluorophenyl)benzoxazol-5-yl]amino}thioxomethyl)ca rboxamide structure](/static/products/401/401614-29-7.png)
(5-bromonaphthyl)-N-({[2-(4-fluorophenyl)benzoxazol-5-yl]amino}thioxomethyl)ca rboxamide
TL;DR: (5-bromonaphthyl)-N-({[2-(4-fluorophenyl)benzoxazol-5-yl]amino}thioxomethyl)ca rboxamide (CAS 401614-29-7) is a chemical compound with molecular formula C25H15BrFN3O2S and molecular weight 519.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-N-[[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]naphthalene-1-carboxamide
Also Known As: (5-bromonaphthyl)-N-({[2-(4-fluorophenyl)benzoxazol-5-yl]amino}thioxomethyl)ca rboxamide, 5-bromo-N-((2-(4-fluorophenyl)benzo[d]oxazol-5-yl)carbamothioyl)-1-naphthamide, 5-bromo-N-[[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]naphthalene-1-carboxamide, 5-bromo-N-[[2-(4-fluorophenyl)benzooxazol-5-yl]thiocarbamoyl]naphthalene-1-carboxamide, 5-bromo-N-{[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]carbamothioyl}naphthalene-1-carboxamide
| Molecular Formula | C25H15BrFN3O2S |
|---|---|
| Molecular Weight | 519.01 g/mol |
| LogP | 6.6764 |
| Topological Polar Surface Area | 67.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 519.00525 |
| Heavy Atoms | 33 |
| Complexity | 1532.5736 |
Chemical Identifiers
| CAS Number | 401614-29-7 |
|---|---|
| SMILES | C1=CC2=C(C=CC=C2Br)C(=C1)C(=O)NC(=S)NC3=CC4=C(C=C3)OC(=N4)C5=CC=C(C=C5)F |
Product Overview
(5-bromonaphthyl)-N-({[2-(4-fluorophenyl)benzoxazol-5-yl]amino}thioxomethyl)ca rboxamide (CAS 401614-29-7), with molecular formula C25H15BrFN3O2S and molecular weight 519.01 g/mol. IUPAC: 5-bromo-N-[[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]naphthalene-1-carboxamide.
Chemical Property Profile of (5-bromonaphthyl)-N-({[2-(4-fluorophenyl)benzoxazol-5-yl]amino}thioxomethyl)ca rboxamide
Property Insights of (5-bromonaphthyl)-N-({[2-(4-fluorophenyl)benzoxazol-5-yl]amino}thioxomethyl)ca rboxamide
The XLogP value of 6.6764 indicates that (5-bromonaphthyl)-N-({[2-(4-fluorophenyl)benzoxazol-5-yl]amino}thioxomethyl)ca rboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.16 Ų falls within the moderate polarity range, balancing permeability and solubility for (5-bromonaphthyl)-N-({[2-(4-fluorophenyl)benzoxazol-5-yl]amino}thioxomethyl)ca rboxamide. Following Lipinski's Rule of Five, (5-bromonaphthyl)-N-({[2-(4-fluorophenyl)benzoxazol-5-yl]amino}thioxomethyl)ca rboxamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (5-bromonaphthyl)-N-({[2-(4-fluorophenyl)benzoxazol-5-yl]amino}thioxomethyl)ca rboxamide?
The CAS number of (5-bromonaphthyl)-N-({[2-(4-fluorophenyl)benzoxazol-5-yl]amino}thioxomethyl)ca rboxamide is 401614-29-7.
What is the molecular formula of (5-bromonaphthyl)-N-({[2-(4-fluorophenyl)benzoxazol-5-yl]amino}thioxomethyl)ca rboxamide?
The molecular formula of (5-bromonaphthyl)-N-({[2-(4-fluorophenyl)benzoxazol-5-yl]amino}thioxomethyl)ca rboxamide is C25H15BrFN3O2S.
What is the molecular weight of (5-bromonaphthyl)-N-({[2-(4-fluorophenyl)benzoxazol-5-yl]amino}thioxomethyl)ca rboxamide?
The molecular weight of (5-bromonaphthyl)-N-({[2-(4-fluorophenyl)benzoxazol-5-yl]amino}thioxomethyl)ca rboxamide is 519.01 g/mol.
Where can I buy (5-bromonaphthyl)-N-({[2-(4-fluorophenyl)benzoxazol-5-yl]amino}thioxomethyl)ca rboxamide?
You can request a quote for (5-bromonaphthyl)-N-({[2-(4-fluorophenyl)benzoxazol-5-yl]amino}thioxomethyl)ca rboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5-bromonaphthyl)-N-({[2-(4-fluorophenyl)benzoxazol-5-yl]amino}thioxomethyl)ca rboxamide?
Yes, KEHONG BIO provides custom synthesis services for (5-bromonaphthyl)-N-({[2-(4-fluorophenyl)benzoxazol-5-yl]amino}thioxomethyl)ca rboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.