![Methyl 4-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]benzoate structure](/static/products/3135/313504-90-4.webp)
Methyl 4-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]benzoate
TL;DR: Methyl 4-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]benzoate (CAS 313504-90-4) is a chemical compound with molecular formula C17H14N2O4S and molecular weight 342.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]benzoate
Also Known As: BAS 03421094, methyl 4-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]benzoate, methyl 4-[N-(6-methoxybenzothiazol-2-yl)carbamoyl]benzoate, methyl 4-((6-methoxybenzo[d]thiazol-2-yl)carbamoyl)benzoate, Methyl 4-[[6-methoxybenzo[d]thiazol-2-yl]carbamoyl]benzoate
| Molecular Formula | C17H14N2O4S |
|---|---|
| Molecular Weight | 342.07 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 342.0674 |
| Heavy Atoms | 24 |
| Complexity | 468.0 |
Chemical Identifiers
| CAS Number | 313504-90-4 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)C(=O)OC |
| InChIKey | JEVHYZCXAAVJDW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 4-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]benzoate (CAS 313504-90-4), with molecular formula C17H14N2O4S and molecular weight 342.07 g/mol. IUPAC: methyl 4-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]benzoate.
Chemical Property Profile of Methyl 4-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]benzoate
Property Insights of Methyl 4-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]benzoate
The XLogP value of 3.4 indicates that Methyl 4-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]benzoate. Following Lipinski's Rule of Five, Methyl 4-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]benzoate has 1 hydrogen bond donor(s) and 6 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 Methyl 4-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]benzoate?
The CAS number of Methyl 4-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]benzoate is 313504-90-4.
What is the molecular formula of Methyl 4-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]benzoate?
The molecular formula of Methyl 4-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]benzoate is C17H14N2O4S.
What is the molecular weight of Methyl 4-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]benzoate?
The molecular weight of Methyl 4-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]benzoate is 342.07 g/mol.
Where can I buy Methyl 4-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]benzoate?
You can request a quote for Methyl 4-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.