![N-[[2-(5-chloronaphthalen-1-yl)benzooxazol-5-yl]thiocarbamoyl]-3-(2-furyl)prop-2-enamide structure](/static/products/472/472977-85-8.png)
N-[[2-(5-chloronaphthalen-1-yl)benzooxazol-5-yl]thiocarbamoyl]-3-(2-furyl)prop-2-enamide
TL;DR: N-[[2-(5-chloronaphthalen-1-yl)benzooxazol-5-yl]thiocarbamoyl]-3-(2-furyl)prop-2-enamide (CAS 472977-85-8) is a chemical compound with molecular formula C25H16ClN3O3S and molecular weight 473.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[[2-(5-chloronaphthalen-1-yl)-1,3-benzoxazol-5-yl]carbamothioyl]-3-(furan-2-yl)prop-2-enamide
Also Known As: N-[[2-(5-chloronaphthalen-1-yl)benzooxazol-5-yl]thiocarbamoyl]-3-(2-furyl)prop-2-enamide, (2E)-N-{[2-(5-chloronaphthalen-1-yl)-1,3-benzoxazol-5-yl]carbamothioyl}-3-(furan-2-yl)prop-2-enamide, (E)-N-((2-(5-chloronaphthalen-1-yl)benzo[d]oxazol-5-yl)carbamothioyl)-3-(furan-2-yl)acrylamide, (E)-N-[[2-(5-chloronaphthalen-1-yl)-1,3-benzoxazol-5-yl]carbamothioyl]-3-(furan-2-yl)prop-2-enamide
| Molecular Formula | C25H16ClN3O3S |
|---|---|
| Molecular Weight | 473.06 g/mol |
| LogP | 6.4208 |
| Topological Polar Surface Area | 80.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 473.0601 |
| Heavy Atoms | 33 |
| Complexity | 1523.0485 |
Chemical Identifiers
| CAS Number | 472977-85-8 |
|---|---|
| SMILES | C1=CC2=C(C=CC=C2Cl)C(=C1)C3=NC4=C(O3)C=CC(=C4)NC(=S)NC(=O)/C=C/C5=CC=CO5 |
Product Overview
N-[[2-(5-chloronaphthalen-1-yl)benzooxazol-5-yl]thiocarbamoyl]-3-(2-furyl)prop-2-enamide (CAS 472977-85-8), with molecular formula C25H16ClN3O3S and molecular weight 473.06 g/mol. IUPAC: (E)-N-[[2-(5-chloronaphthalen-1-yl)-1,3-benzoxazol-5-yl]carbamothioyl]-3-(furan-2-yl)prop-2-enamide.
Chemical Property Profile of N-[[2-(5-chloronaphthalen-1-yl)benzooxazol-5-yl]thiocarbamoyl]-3-(2-furyl)prop-2-enamide
Property Insights of N-[[2-(5-chloronaphthalen-1-yl)benzooxazol-5-yl]thiocarbamoyl]-3-(2-furyl)prop-2-enamide
The XLogP value of 6.4208 indicates that N-[[2-(5-chloronaphthalen-1-yl)benzooxazol-5-yl]thiocarbamoyl]-3-(2-furyl)prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[[2-(5-chloronaphthalen-1-yl)benzooxazol-5-yl]thiocarbamoyl]-3-(2-furyl)prop-2-enamide. Following Lipinski's Rule of Five, N-[[2-(5-chloronaphthalen-1-yl)benzooxazol-5-yl]thiocarbamoyl]-3-(2-furyl)prop-2-enamide 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-[[2-(5-chloronaphthalen-1-yl)benzooxazol-5-yl]thiocarbamoyl]-3-(2-furyl)prop-2-enamide?
The CAS number of N-[[2-(5-chloronaphthalen-1-yl)benzooxazol-5-yl]thiocarbamoyl]-3-(2-furyl)prop-2-enamide is 472977-85-8.
What is the molecular formula of N-[[2-(5-chloronaphthalen-1-yl)benzooxazol-5-yl]thiocarbamoyl]-3-(2-furyl)prop-2-enamide?
The molecular formula of N-[[2-(5-chloronaphthalen-1-yl)benzooxazol-5-yl]thiocarbamoyl]-3-(2-furyl)prop-2-enamide is C25H16ClN3O3S.
What is the molecular weight of N-[[2-(5-chloronaphthalen-1-yl)benzooxazol-5-yl]thiocarbamoyl]-3-(2-furyl)prop-2-enamide?
The molecular weight of N-[[2-(5-chloronaphthalen-1-yl)benzooxazol-5-yl]thiocarbamoyl]-3-(2-furyl)prop-2-enamide is 473.06 g/mol.
Where can I buy N-[[2-(5-chloronaphthalen-1-yl)benzooxazol-5-yl]thiocarbamoyl]-3-(2-furyl)prop-2-enamide?
You can request a quote for N-[[2-(5-chloronaphthalen-1-yl)benzooxazol-5-yl]thiocarbamoyl]-3-(2-furyl)prop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[[2-(5-chloronaphthalen-1-yl)benzooxazol-5-yl]thiocarbamoyl]-3-(2-furyl)prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[2-(5-chloronaphthalen-1-yl)benzooxazol-5-yl]thiocarbamoyl]-3-(2-furyl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.