1-butyl-2-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole
TL;DR: 1-butyl-2-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole (CAS 736188-82-2) is a chemical compound with molecular formula C16H23N3O3S and molecular weight 337.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1-butyl-2-methylbenzimidazol-5-yl)sulfonylmorpholine
Also Known As: 1-butyl-2-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole, 1-Butyl-2-methyl-5-(morpholine-4-sulfonyl)-1H-benzoimidazole, 4-(1-butyl-2-methylbenzimidazol-5-yl)sulfonylmorpholine, 4-(1-butyl-2-methyl-benzimidazol-5-yl)sulfonylmorpholine
| Molecular Formula | C16H23N3O3S |
|---|---|
| Molecular Weight | 337.15 g/mol |
| LogP | 2.16572 |
| Topological Polar Surface Area | 64.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 337.14603 |
| Heavy Atoms | 23 |
| Complexity | 792.24854 |
Chemical Identifiers
| CAS Number | 736188-82-2 |
|---|---|
| SMILES | CCCCN1C(=NC2=C1C=CC(=C2)S(=O)(=O)N3CCOCC3)C |
Product Overview
1-butyl-2-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole (CAS 736188-82-2), with molecular formula C16H23N3O3S and molecular weight 337.15 g/mol. IUPAC: 4-(1-butyl-2-methylbenzimidazol-5-yl)sulfonylmorpholine.
Chemical Property Profile of 1-butyl-2-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole
Property Insights of 1-butyl-2-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole
The XLogP value of 2.16572 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-butyl-2-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole. The TPSA of 64.43 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-butyl-2-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole. Following Lipinski's Rule of Five, 1-butyl-2-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole has 0 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 1-butyl-2-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole?
The CAS number of 1-butyl-2-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole is 736188-82-2.
What is the molecular formula of 1-butyl-2-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole?
The molecular formula of 1-butyl-2-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole is C16H23N3O3S.
What is the molecular weight of 1-butyl-2-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole?
The molecular weight of 1-butyl-2-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole is 337.15 g/mol.
Where can I buy 1-butyl-2-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole?
You can request a quote for 1-butyl-2-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-butyl-2-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole?
Yes, KEHONG BIO provides custom synthesis services for 1-butyl-2-methyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.