N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)propanamide
TL;DR: N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)propanamide (CAS 683237-32-3) is a chemical compound with molecular formula C12H14N2O3S2 and molecular weight 298.04 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)propanamide
Also Known As: N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)propanamide, (Z)-N-(3-methyl-6-(methylsulfonyl)benzo[d]thiazol-2(3H)-ylidene)propionamide, F1105-0348, N-[(2Z)-6-methanesulfonyl-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]propanamide, N-(3-methyl-6-methylsulfonyl-benzothiazol-2-ylidene)propanamide
| Molecular Formula | C12H14N2O3S2 |
|---|---|
| Molecular Weight | 298.04 g/mol |
| LogP | 1.4806 |
| Topological Polar Surface Area | 68.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 298.0446 |
| Heavy Atoms | 19 |
| Complexity | 813.10236 |
Chemical Identifiers
| CAS Number | 683237-32-3 |
|---|---|
| SMILES | CCC(=O)N=C1N(C2=C(S1)C=C(C=C2)S(=O)(=O)C)C |
Product Overview
N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)propanamide (CAS 683237-32-3), with molecular formula C12H14N2O3S2 and molecular weight 298.04 g/mol. IUPAC: N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)propanamide.
Chemical Property Profile of N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)propanamide
Property Insights of N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)propanamide
The XLogP value of 1.4806 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)propanamide. 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)propanamide. Following Lipinski's Rule of Five, N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)propanamide 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)propanamide?
The CAS number of N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)propanamide is 683237-32-3.
What is the molecular formula of N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)propanamide?
The molecular formula of N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)propanamide is C12H14N2O3S2.
What is the molecular weight of N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)propanamide?
The molecular weight of N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)propanamide is 298.04 g/mol.
Where can I buy N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)propanamide?
You can request a quote for N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)propanamide 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)propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.