![N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide structure](/static/products/5651/565180-34-9.webp)
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide
TL;DR: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide (CAS 565180-34-9) is a chemical compound with molecular formula C13H13N3O4S and molecular weight 307.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide
Also Known As: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide, N-(1,3-benzodioxol-5-ylmethyl)-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide, N-(2H-benzo[3,4-d]1,3-dioxolen-5-ylmethyl)-2-(5-methyl(1,3,4-oxadiazol-2-ylthi o))acetamide
| Molecular Formula | C13H13N3O4S |
|---|---|
| Molecular Weight | 307.06 g/mol |
| LogP | 1.51522 |
| Topological Polar Surface Area | 86.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 307.06268 |
| Heavy Atoms | 21 |
| Complexity | 658.61597 |
Chemical Identifiers
| CAS Number | 565180-34-9 |
|---|---|
| SMILES | CC1=NN=C(O1)SCC(=O)NCC2=CC3=C(C=C2)OCO3 |
Product Overview
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide (CAS 565180-34-9), with molecular formula C13H13N3O4S and molecular weight 307.06 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide.
Chemical Property Profile of N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide
Property Insights of N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide
The XLogP value of 1.51522 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide. The TPSA of 86.48 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide. Following Lipinski's Rule of Five, N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide?
The CAS number of N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide is 565180-34-9.
What is the molecular formula of N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide?
The molecular formula of N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide is C13H13N3O4S.
What is the molecular weight of N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide?
The molecular weight of N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide is 307.06 g/mol.
Where can I buy N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide?
You can request a quote for N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.