N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-phenylpropanamide
TL;DR: N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-phenylpropanamide (CAS 683238-12-2) is a chemical compound with molecular formula C18H18N2O3S2 and molecular weight 374.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-phenylpropanamide
Also Known As: F1105-0428, N-[(2Z)-6-methanesulfonyl-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]-3-phenylpropanamide, N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-phenylpropanamide, (Z)-N-(3-methyl-6-(methylsulfonyl)benzo[d]thiazol-2(3H)-ylidene)-3-phenylpropanamide, N-(3-methyl-6-methylsulfonyl-benzothiazol-2-ylidene)-3-phenyl-propanamide
| Molecular Formula | C18H18N2O3S2 |
|---|---|
| Molecular Weight | 374.08 g/mol |
| LogP | 2.7034 |
| Topological Polar Surface Area | 68.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 374.0759 |
| Heavy Atoms | 25 |
| Complexity | 1094.3016 |
Chemical Identifiers
| CAS Number | 683238-12-2 |
|---|---|
| SMILES | CN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)CCC3=CC=CC=C3 |
Product Overview
N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-phenylpropanamide (CAS 683238-12-2), with molecular formula C18H18N2O3S2 and molecular weight 374.08 g/mol. IUPAC: N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-phenylpropanamide.
Chemical Property Profile of N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-phenylpropanamide
Property Insights of N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-phenylpropanamide
The XLogP value of 2.7034 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-phenylpropanamide. The TPSA of 68.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-phenylpropanamide. Following Lipinski's Rule of Five, N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-phenylpropanamide 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 N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-phenylpropanamide?
The CAS number of N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-phenylpropanamide is 683238-12-2.
What is the molecular formula of N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-phenylpropanamide?
The molecular formula of N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-phenylpropanamide is C18H18N2O3S2.
What is the molecular weight of N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-phenylpropanamide?
The molecular weight of N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-phenylpropanamide is 374.08 g/mol.
Where can I buy N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-phenylpropanamide?
You can request a quote for N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-phenylpropanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-phenylpropanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-phenylpropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.