![N-(5-(Benzo[d][1,3]dioxol-5-yl)-1,3,4-thiadiazol-2-yl)-2-(3-(2-ethylphenyl)ureido)-3-phenylpropanamide structure](/static/products/1038/1038745-31-1.webp)
N-(5-(Benzo[d][1,3]dioxol-5-yl)-1,3,4-thiadiazol-2-yl)-2-(3-(2-ethylphenyl)ureido)-3-phenylpropanamide
TL;DR: N-(5-(Benzo[d][1,3]dioxol-5-yl)-1,3,4-thiadiazol-2-yl)-2-(3-(2-ethylphenyl)ureido)-3-phenylpropanamide (CAS 1038745-31-1) is a chemical compound with molecular formula C27H25N5O4S and molecular weight 515.1627 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-2-[(2-ethylphenyl)carbamoylamino]-3-phenylpropanamide
Also Known As: N-(5-(Benzo[d][1,3]dioxol-5-yl)-1,3,4-thiadiazol-2-yl)-2-(3-(2-ethylphenyl)ureido)-3-phenylpropanamide, N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-2-[(2-ethylphenyl)carbamoylamino]-3-phenylpropanamide
Technical Specifications
| Molecular Formula | C27H25N5O4S |
| Molecular Weight | 515.1627 g/mol |
| XLogP | 4.9 |
| Topological Polar Surface Area (TPSA) | 143.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 515.1627 Da |
| Heavy Atoms | 37 |
| Complexity | 769.0 |
| SMILES | CCC1=CC=CC=C1NC(=O)NC(CC2=CC=CC=C2)C(=O)NC3=NN=C(S3)C4=CC5=C(C=C4)OCO5 |
| InChIKey | OCYSTWSDPIFIIL-UHFFFAOYSA-N |
Chemical Property Profile of N-(5-(Benzo[d][1,3]dioxol-5-yl)-1,3,4-thiadiazol-2-yl)-2-(3-(2-ethylphenyl)ureido)-3-phenylpropanamide
Property Insights of N-(5-(Benzo[d][1,3]dioxol-5-yl)-1,3,4-thiadiazol-2-yl)-2-(3-(2-ethylphenyl)ureido)-3-phenylpropanamide
The XLogP value of 4.9 indicates that N-(5-(Benzo[d][1,3]dioxol-5-yl)-1,3,4-thiadiazol-2-yl)-2-(3-(2-ethylphenyl)ureido)-3-phenylpropanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 143.0 Ų indicates high polarity, suggesting N-(5-(Benzo[d][1,3]dioxol-5-yl)-1,3,4-thiadiazol-2-yl)-2-(3-(2-ethylphenyl)ureido)-3-phenylpropanamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(5-(Benzo[d][1,3]dioxol-5-yl)-1,3,4-thiadiazol-2-yl)-2-(3-(2-ethylphenyl)ureido)-3-phenylpropanamide has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of N-(5-(Benzo[d][1,3]dioxol-5-yl)-1,3,4-thiadiazol-2-yl)-2-(3-(2-ethylphenyl)ureido)-3-phenylpropanamide?
The CAS number of N-(5-(Benzo[d][1,3]dioxol-5-yl)-1,3,4-thiadiazol-2-yl)-2-(3-(2-ethylphenyl)ureido)-3-phenylpropanamide is 1038745-31-1.
What is the molecular formula of N-(5-(Benzo[d][1,3]dioxol-5-yl)-1,3,4-thiadiazol-2-yl)-2-(3-(2-ethylphenyl)ureido)-3-phenylpropanamide?
The molecular formula of N-(5-(Benzo[d][1,3]dioxol-5-yl)-1,3,4-thiadiazol-2-yl)-2-(3-(2-ethylphenyl)ureido)-3-phenylpropanamide is C27H25N5O4S.
What is the molecular weight of N-(5-(Benzo[d][1,3]dioxol-5-yl)-1,3,4-thiadiazol-2-yl)-2-(3-(2-ethylphenyl)ureido)-3-phenylpropanamide?
The molecular weight of N-(5-(Benzo[d][1,3]dioxol-5-yl)-1,3,4-thiadiazol-2-yl)-2-(3-(2-ethylphenyl)ureido)-3-phenylpropanamide is 515.1627 g/mol.
Where can I buy N-(5-(Benzo[d][1,3]dioxol-5-yl)-1,3,4-thiadiazol-2-yl)-2-(3-(2-ethylphenyl)ureido)-3-phenylpropanamide?
You can request a quote for N-(5-(Benzo[d][1,3]dioxol-5-yl)-1,3,4-thiadiazol-2-yl)-2-(3-(2-ethylphenyl)ureido)-3-phenylpropanamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(5-(Benzo[d][1,3]dioxol-5-yl)-1,3,4-thiadiazol-2-yl)-2-(3-(2-ethylphenyl)ureido)-3-phenylpropanamide?
Yes, CoreyChem provides custom synthesis services for N-(5-(Benzo[d][1,3]dioxol-5-yl)-1,3,4-thiadiazol-2-yl)-2-(3-(2-ethylphenyl)ureido)-3-phenylpropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.