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Benzo[d]thiazol-2-ylmethyl 4-benzoylbenzoate
TL;DR: Benzo[d]thiazol-2-ylmethyl 4-benzoylbenzoate (CAS 325987-62-0) is a chemical compound with molecular formula C22H15NO3S and molecular weight 373.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-benzothiazol-2-ylmethyl 4-benzoylbenzoate
Also Known As: benzo[d]thiazol-2-ylmethyl 4-benzoylbenzoate, (1,3-benzothiazol-2-yl)methyl 4-benzoylbenzoate, 1,3-benzothiazol-2-ylmethyl 4-benzoylbenzoate, AB00684073-01, F0193-0070
| Molecular Formula | C22H15NO3S |
|---|---|
| Molecular Weight | 373.08 g/mol |
| LogP | 4.8843 |
| Topological Polar Surface Area | 56.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 373.07727 |
| Heavy Atoms | 27 |
| Complexity | 1068.3379 |
Chemical Identifiers
| CAS Number | 325987-62-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C(=O)OCC3=NC4=CC=CC=C4S3 |
Product Overview
Benzo[d]thiazol-2-ylmethyl 4-benzoylbenzoate (CAS 325987-62-0), with molecular formula C22H15NO3S and molecular weight 373.08 g/mol. IUPAC: 1,3-benzothiazol-2-ylmethyl 4-benzoylbenzoate.
Chemical Property Profile of Benzo[d]thiazol-2-ylmethyl 4-benzoylbenzoate
Property Insights of Benzo[d]thiazol-2-ylmethyl 4-benzoylbenzoate
The XLogP value of 4.8843 indicates that Benzo[d]thiazol-2-ylmethyl 4-benzoylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.26 Ų, Benzo[d]thiazol-2-ylmethyl 4-benzoylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo[d]thiazol-2-ylmethyl 4-benzoylbenzoate has 0 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 Benzo[d]thiazol-2-ylmethyl 4-benzoylbenzoate?
The CAS number of Benzo[d]thiazol-2-ylmethyl 4-benzoylbenzoate is 325987-62-0.
What is the molecular formula of Benzo[d]thiazol-2-ylmethyl 4-benzoylbenzoate?
The molecular formula of Benzo[d]thiazol-2-ylmethyl 4-benzoylbenzoate is C22H15NO3S.
What is the molecular weight of Benzo[d]thiazol-2-ylmethyl 4-benzoylbenzoate?
The molecular weight of Benzo[d]thiazol-2-ylmethyl 4-benzoylbenzoate is 373.08 g/mol.
Where can I buy Benzo[d]thiazol-2-ylmethyl 4-benzoylbenzoate?
You can request a quote for Benzo[d]thiazol-2-ylmethyl 4-benzoylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzo[d]thiazol-2-ylmethyl 4-benzoylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for Benzo[d]thiazol-2-ylmethyl 4-benzoylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.