![3-(2-isopropoxybenzyl)benzo[d]thiazol-2(3H)-one structure](/static/products/797/797780-57-5.png)
3-(2-isopropoxybenzyl)benzo[d]thiazol-2(3H)-one
TL;DR: 3-(2-isopropoxybenzyl)benzo[d]thiazol-2(3H)-one (CAS 797780-57-5) 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-[(2-propan-2-yloxyphenyl)methyl]-1,3-benzothiazol-2-one
Also Known As: BAS 08977240, 3-(2-isopropoxybenzyl)benzo[d]thiazol-2(3H)-one, 3-{[2-(propan-2-yloxy)phenyl]methyl}-2,3-dihydro-1,3-benzothiazol-2-one, 3-(2-Isopropoxy-benzyl)-3H-benzothiazol-2-one, 3-[(2-propan-2-yloxyphenyl)methyl]-1,3-benzothiazol-2-one
| Molecular Formula | C17H17NO2S |
|---|---|
| Molecular Weight | 299.10 g/mol |
| LogP | 3.8985 |
| Topological Polar Surface Area | 31.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 299.098 |
| Heavy Atoms | 21 |
| Complexity | 816.7682 |
Chemical Identifiers
| CAS Number | 797780-57-5 |
|---|---|
| SMILES | CC(C)OC1=CC=CC=C1CN2C3=CC=CC=C3SC2=O |
Product Overview
3-(2-isopropoxybenzyl)benzo[d]thiazol-2(3H)-one (CAS 797780-57-5), with molecular formula C17H17NO2S and molecular weight 299.10 g/mol. IUPAC: 3-[(2-propan-2-yloxyphenyl)methyl]-1,3-benzothiazol-2-one.
Chemical Property Profile of 3-(2-isopropoxybenzyl)benzo[d]thiazol-2(3H)-one
Property Insights of 3-(2-isopropoxybenzyl)benzo[d]thiazol-2(3H)-one
The XLogP value of 3.8985 indicates that 3-(2-isopropoxybenzyl)benzo[d]thiazol-2(3H)-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-(2-isopropoxybenzyl)benzo[d]thiazol-2(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-isopropoxybenzyl)benzo[d]thiazol-2(3H)-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-(2-isopropoxybenzyl)benzo[d]thiazol-2(3H)-one?
The CAS number of 3-(2-isopropoxybenzyl)benzo[d]thiazol-2(3H)-one is 797780-57-5.
What is the molecular formula of 3-(2-isopropoxybenzyl)benzo[d]thiazol-2(3H)-one?
The molecular formula of 3-(2-isopropoxybenzyl)benzo[d]thiazol-2(3H)-one is C17H17NO2S.
What is the molecular weight of 3-(2-isopropoxybenzyl)benzo[d]thiazol-2(3H)-one?
The molecular weight of 3-(2-isopropoxybenzyl)benzo[d]thiazol-2(3H)-one is 299.10 g/mol.
Where can I buy 3-(2-isopropoxybenzyl)benzo[d]thiazol-2(3H)-one?
You can request a quote for 3-(2-isopropoxybenzyl)benzo[d]thiazol-2(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-isopropoxybenzyl)benzo[d]thiazol-2(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-isopropoxybenzyl)benzo[d]thiazol-2(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.