![3-[1-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazol-2-yl]propanoic acid structure](/static/products/7318/731820-90-9.webp)
3-[1-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazol-2-yl]propanoic acid
TL;DR: 3-[1-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazol-2-yl]propanoic acid (CAS 731820-90-9) is a chemical compound with molecular formula C15H19N3O5S and molecular weight 353.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1-methyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)propanoic acid
Also Known As: 3-[1-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazol-2-yl]propanoic acid, 3-[1-methyl-5-(morpholin-4-ylsulfonyl)-1H-benzimidazol-2-yl]propanoic acid, 3-(1-methyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)propanoic acid, 3-(1-methyl-5-morpholin-4-ylsulfonyl-benzoimidazol-2-yl)propanoic Acid, 3-(3-methyl-6-morpholinosulfonyl-1H-benzimidazol-3-ium-2-yl)propanoate
| Molecular Formula | C15H19N3O5S |
|---|---|
| Molecular Weight | 353.10 g/mol |
| LogP | 0.6114 |
| Topological Polar Surface Area | 101.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 353.10455 |
| Heavy Atoms | 24 |
| Complexity | 868.607 |
Chemical Identifiers
| CAS Number | 731820-90-9 |
|---|---|
| SMILES | CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CCC(=O)O |
Product Overview
3-[1-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazol-2-yl]propanoic acid (CAS 731820-90-9), with molecular formula C15H19N3O5S and molecular weight 353.10 g/mol. IUPAC: 3-(1-methyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)propanoic acid.
Chemical Property Profile of 3-[1-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazol-2-yl]propanoic acid
Property Insights of 3-[1-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazol-2-yl]propanoic acid
The XLogP value of 0.6114 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[1-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazol-2-yl]propanoic acid. The TPSA of 101.73 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[1-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazol-2-yl]propanoic acid. Following Lipinski's Rule of Five, 3-[1-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazol-2-yl]propanoic acid has 1 hydrogen bond donor(s) and 5 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 3-[1-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazol-2-yl]propanoic acid?
The CAS number of 3-[1-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazol-2-yl]propanoic acid is 731820-90-9.
What is the molecular formula of 3-[1-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazol-2-yl]propanoic acid?
The molecular formula of 3-[1-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazol-2-yl]propanoic acid is C15H19N3O5S.
What is the molecular weight of 3-[1-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazol-2-yl]propanoic acid?
The molecular weight of 3-[1-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazol-2-yl]propanoic acid is 353.10 g/mol.
Where can I buy 3-[1-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazol-2-yl]propanoic acid?
You can request a quote for 3-[1-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazol-2-yl]propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[1-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazol-2-yl]propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[1-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazol-2-yl]propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.