N-(5-methyl-2,1,3-benzothiadiazol-4-yl)propanamide
TL;DR: N-(5-methyl-2,1,3-benzothiadiazol-4-yl)propanamide (CAS 425606-01-5) is a chemical compound with molecular formula C10H11N3OS and molecular weight 221.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-methyl-2,1,3-benzothiadiazol-4-yl)propanamide
Also Known As: N-(5-methyl-2,1,3-benzothiadiazol-4-yl)propanamide, BAS 02242109, BIM-0021953.P001, AB00103847-01, BRD-K54555905-001-08-2
| Molecular Formula | C10H11N3OS |
|---|---|
| Molecular Weight | 221.06 g/mol |
| LogP | 2.34822 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 221.06229 |
| Heavy Atoms | 15 |
| Complexity | 506.33685 |
Chemical Identifiers
| CAS Number | 425606-01-5 |
|---|---|
| SMILES | CCC(=O)NC1=C(C=CC2=NSN=C21)C |
Product Overview
N-(5-methyl-2,1,3-benzothiadiazol-4-yl)propanamide (CAS 425606-01-5), with molecular formula C10H11N3OS and molecular weight 221.06 g/mol. IUPAC: N-(5-methyl-2,1,3-benzothiadiazol-4-yl)propanamide.
Chemical Property Profile of N-(5-methyl-2,1,3-benzothiadiazol-4-yl)propanamide
Property Insights of N-(5-methyl-2,1,3-benzothiadiazol-4-yl)propanamide
The XLogP value of 2.34822 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(5-methyl-2,1,3-benzothiadiazol-4-yl)propanamide. With a topological polar surface area (TPSA) of 54.88 Ų, N-(5-methyl-2,1,3-benzothiadiazol-4-yl)propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(5-methyl-2,1,3-benzothiadiazol-4-yl)propanamide has 1 hydrogen bond donor(s) and 4 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-(5-methyl-2,1,3-benzothiadiazol-4-yl)propanamide?
The CAS number of N-(5-methyl-2,1,3-benzothiadiazol-4-yl)propanamide is 425606-01-5.
What is the molecular formula of N-(5-methyl-2,1,3-benzothiadiazol-4-yl)propanamide?
The molecular formula of N-(5-methyl-2,1,3-benzothiadiazol-4-yl)propanamide is C10H11N3OS.
What is the molecular weight of N-(5-methyl-2,1,3-benzothiadiazol-4-yl)propanamide?
The molecular weight of N-(5-methyl-2,1,3-benzothiadiazol-4-yl)propanamide is 221.06 g/mol.
Where can I buy N-(5-methyl-2,1,3-benzothiadiazol-4-yl)propanamide?
You can request a quote for N-(5-methyl-2,1,3-benzothiadiazol-4-yl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(5-methyl-2,1,3-benzothiadiazol-4-yl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(5-methyl-2,1,3-benzothiadiazol-4-yl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.