![3-(2,4-dichlorophenyl)-N-[(2-naphthalen-1-ylbenzooxazol-5-yl)thiocarbamoyl]prop-2-enamide structure](/static/products/532/532407-80-0.png)
3-(2,4-dichlorophenyl)-N-[(2-naphthalen-1-ylbenzooxazol-5-yl)thiocarbamoyl]prop-2-enamide
TL;DR: 3-(2,4-dichlorophenyl)-N-[(2-naphthalen-1-ylbenzooxazol-5-yl)thiocarbamoyl]prop-2-enamide (CAS 532407-80-0) is a chemical compound with molecular formula C27H17Cl2N3O2S and molecular weight 517.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(2,4-dichlorophenyl)-N-[(2-naphthalen-1-yl-1,3-benzoxazol-5-yl)carbamothioyl]prop-2-enamide
Also Known As: 3-(2,4-dichlorophenyl)-N-[(2-naphthalen-1-ylbenzooxazol-5-yl)thiocarbamoyl]prop-2-enamide, (2E)-3-(2,4-dichlorophenyl)-N-{[(2-naphthylbenzoxazol-5-yl)amino]thioxomethyl} prop-2-enamide, (2E)-3-(2,4-dichlorophenyl)-N-{[2-(naphthalen-1-yl)-1,3-benzoxazol-5-yl]carbamothioyl}prop-2-enamide, (E)-3-(2,4-dichlorophenyl)-N-((2-(naphthalen-1-yl)benzo[d]oxazol-5-yl)carbamothioyl)acrylamide, (E)-3-(2,4-dichlorophenyl)-N-[(2-naphthalen-1-yl-1,3-benzoxazol-5-yl)carbamothioyl]prop-2-enamide
| Molecular Formula | C27H17Cl2N3O2S |
|---|---|
| Molecular Weight | 517.04 g/mol |
| LogP | 7.4812 |
| Topological Polar Surface Area | 67.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 517.0419 |
| Heavy Atoms | 35 |
| Complexity | 1622.7068 |
Chemical Identifiers
| CAS Number | 532407-80-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2C3=NC4=C(O3)C=CC(=C4)NC(=S)NC(=O)/C=C/C5=C(C=C(C=C5)Cl)Cl |
Product Overview
3-(2,4-dichlorophenyl)-N-[(2-naphthalen-1-ylbenzooxazol-5-yl)thiocarbamoyl]prop-2-enamide (CAS 532407-80-0), with molecular formula C27H17Cl2N3O2S and molecular weight 517.04 g/mol. IUPAC: (E)-3-(2,4-dichlorophenyl)-N-[(2-naphthalen-1-yl-1,3-benzoxazol-5-yl)carbamothioyl]prop-2-enamide.
Chemical Property Profile of 3-(2,4-dichlorophenyl)-N-[(2-naphthalen-1-ylbenzooxazol-5-yl)thiocarbamoyl]prop-2-enamide
Property Insights of 3-(2,4-dichlorophenyl)-N-[(2-naphthalen-1-ylbenzooxazol-5-yl)thiocarbamoyl]prop-2-enamide
The XLogP value of 7.4812 indicates that 3-(2,4-dichlorophenyl)-N-[(2-naphthalen-1-ylbenzooxazol-5-yl)thiocarbamoyl]prop-2-enamide 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 3-(2,4-dichlorophenyl)-N-[(2-naphthalen-1-ylbenzooxazol-5-yl)thiocarbamoyl]prop-2-enamide. Following Lipinski's Rule of Five, 3-(2,4-dichlorophenyl)-N-[(2-naphthalen-1-ylbenzooxazol-5-yl)thiocarbamoyl]prop-2-enamide 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 3-(2,4-dichlorophenyl)-N-[(2-naphthalen-1-ylbenzooxazol-5-yl)thiocarbamoyl]prop-2-enamide?
The CAS number of 3-(2,4-dichlorophenyl)-N-[(2-naphthalen-1-ylbenzooxazol-5-yl)thiocarbamoyl]prop-2-enamide is 532407-80-0.
What is the molecular formula of 3-(2,4-dichlorophenyl)-N-[(2-naphthalen-1-ylbenzooxazol-5-yl)thiocarbamoyl]prop-2-enamide?
The molecular formula of 3-(2,4-dichlorophenyl)-N-[(2-naphthalen-1-ylbenzooxazol-5-yl)thiocarbamoyl]prop-2-enamide is C27H17Cl2N3O2S.
What is the molecular weight of 3-(2,4-dichlorophenyl)-N-[(2-naphthalen-1-ylbenzooxazol-5-yl)thiocarbamoyl]prop-2-enamide?
The molecular weight of 3-(2,4-dichlorophenyl)-N-[(2-naphthalen-1-ylbenzooxazol-5-yl)thiocarbamoyl]prop-2-enamide is 517.04 g/mol.
Where can I buy 3-(2,4-dichlorophenyl)-N-[(2-naphthalen-1-ylbenzooxazol-5-yl)thiocarbamoyl]prop-2-enamide?
You can request a quote for 3-(2,4-dichlorophenyl)-N-[(2-naphthalen-1-ylbenzooxazol-5-yl)thiocarbamoyl]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 3-(2,4-dichlorophenyl)-N-[(2-naphthalen-1-ylbenzooxazol-5-yl)thiocarbamoyl]prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,4-dichlorophenyl)-N-[(2-naphthalen-1-ylbenzooxazol-5-yl)thiocarbamoyl]prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.