![4-methyl-N-{2-[(2-oxopropyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide structure](/static/products/530/530145-91-6.png)
4-methyl-N-{2-[(2-oxopropyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide
TL;DR: 4-methyl-N-{2-[(2-oxopropyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide (CAS 530145-91-6) is a chemical compound with molecular formula C18H16N2O2S2 and molecular weight 356.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-N-[2-(2-oxopropylsulfanyl)-1,3-benzothiazol-6-yl]benzamide
Also Known As: 4-methyl-N-(2-((2-oxopropyl)thio)benzo[d]thiazol-6-yl)benzamide, 4-methyl-N-[2-(2-oxopropylsulfanyl)-1,3-benzothiazol-6-yl]benzamide, 4-methyl-N-{2-[(2-oxopropyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide
| Molecular Formula | C18H16N2O2S2 |
|---|---|
| Molecular Weight | 356.07 g/mol |
| LogP | 4.53812 |
| Topological Polar Surface Area | 59.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 356.0653 |
| Heavy Atoms | 24 |
| Complexity | 901.0277 |
Chemical Identifiers
| CAS Number | 530145-91-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)C |
Product Overview
4-methyl-N-{2-[(2-oxopropyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide (CAS 530145-91-6), with molecular formula C18H16N2O2S2 and molecular weight 356.07 g/mol. IUPAC: 4-methyl-N-[2-(2-oxopropylsulfanyl)-1,3-benzothiazol-6-yl]benzamide.
Chemical Property Profile of 4-methyl-N-{2-[(2-oxopropyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide
Property Insights of 4-methyl-N-{2-[(2-oxopropyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide
The XLogP value of 4.53812 indicates that 4-methyl-N-{2-[(2-oxopropyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.06 Ų, 4-methyl-N-{2-[(2-oxopropyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-methyl-N-{2-[(2-oxopropyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide 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 4-methyl-N-{2-[(2-oxopropyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide?
The CAS number of 4-methyl-N-{2-[(2-oxopropyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide is 530145-91-6.
What is the molecular formula of 4-methyl-N-{2-[(2-oxopropyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide?
The molecular formula of 4-methyl-N-{2-[(2-oxopropyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide is C18H16N2O2S2.
What is the molecular weight of 4-methyl-N-{2-[(2-oxopropyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide?
The molecular weight of 4-methyl-N-{2-[(2-oxopropyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide is 356.07 g/mol.
Where can I buy 4-methyl-N-{2-[(2-oxopropyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide?
You can request a quote for 4-methyl-N-{2-[(2-oxopropyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methyl-N-{2-[(2-oxopropyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-methyl-N-{2-[(2-oxopropyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.