![3-[3-(4-Methylphenoxy)propyl]-2,3-dihydro-1,3-benzothiazol-2-one structure](/static/products/842/842956-97-2.png)
3-[3-(4-Methylphenoxy)propyl]-2,3-dihydro-1,3-benzothiazol-2-one
TL;DR: 3-[3-(4-Methylphenoxy)propyl]-2,3-dihydro-1,3-benzothiazol-2-one (CAS 842956-97-2) is a chemical compound with molecular formula C17H17NO2S and molecular weight 299.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-(4-methylphenoxy)propyl]-1,3-benzothiazol-2-one
Also Known As: 3-(3-p-Tolyloxy-propyl)-3H-benzothiazol-2-one, BAS 08977227, 3-[3-(4-methylphenoxy)propyl]-2,3-dihydro-1,3-benzothiazol-2-one, 3-(3-(p-tolyloxy)propyl)benzo[d]thiazol-2(3H)-one, 3-[3-(4-methylphenoxy)propyl]-1,3-benzothiazol-2-one
| Molecular Formula | C17H17NO2S |
|---|---|
| Molecular Weight | 299.10 g/mol |
| LogP | 3.84052 |
| Topological Polar Surface Area | 31.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 299.098 |
| Heavy Atoms | 21 |
| Complexity | 786.40533 |
Chemical Identifiers
| CAS Number | 842956-97-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OCCCN2C3=CC=CC=C3SC2=O |
Product Overview
3-[3-(4-Methylphenoxy)propyl]-2,3-dihydro-1,3-benzothiazol-2-one (CAS 842956-97-2), with molecular formula C17H17NO2S and molecular weight 299.10 g/mol. IUPAC: 3-[3-(4-methylphenoxy)propyl]-1,3-benzothiazol-2-one.
Chemical Property Profile of 3-[3-(4-Methylphenoxy)propyl]-2,3-dihydro-1,3-benzothiazol-2-one
Property Insights of 3-[3-(4-Methylphenoxy)propyl]-2,3-dihydro-1,3-benzothiazol-2-one
The XLogP value of 3.84052 indicates that 3-[3-(4-Methylphenoxy)propyl]-2,3-dihydro-1,3-benzothiazol-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.23 Ų, 3-[3-(4-Methylphenoxy)propyl]-2,3-dihydro-1,3-benzothiazol-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[3-(4-Methylphenoxy)propyl]-2,3-dihydro-1,3-benzothiazol-2-one has 0 hydrogen bond donor(s) and 3 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-[3-(4-Methylphenoxy)propyl]-2,3-dihydro-1,3-benzothiazol-2-one?
The CAS number of 3-[3-(4-Methylphenoxy)propyl]-2,3-dihydro-1,3-benzothiazol-2-one is 842956-97-2.
What is the molecular formula of 3-[3-(4-Methylphenoxy)propyl]-2,3-dihydro-1,3-benzothiazol-2-one?
The molecular formula of 3-[3-(4-Methylphenoxy)propyl]-2,3-dihydro-1,3-benzothiazol-2-one is C17H17NO2S.
What is the molecular weight of 3-[3-(4-Methylphenoxy)propyl]-2,3-dihydro-1,3-benzothiazol-2-one?
The molecular weight of 3-[3-(4-Methylphenoxy)propyl]-2,3-dihydro-1,3-benzothiazol-2-one is 299.10 g/mol.
Where can I buy 3-[3-(4-Methylphenoxy)propyl]-2,3-dihydro-1,3-benzothiazol-2-one?
You can request a quote for 3-[3-(4-Methylphenoxy)propyl]-2,3-dihydro-1,3-benzothiazol-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[3-(4-Methylphenoxy)propyl]-2,3-dihydro-1,3-benzothiazol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[3-(4-Methylphenoxy)propyl]-2,3-dihydro-1,3-benzothiazol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.