![Methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)benzo[d]thiazole-6-carboxylate structure](/static/products/888/888409-23-2.png)
Methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)benzo[d]thiazole-6-carboxylate
TL;DR: Methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)benzo[d]thiazole-6-carboxylate (CAS 888409-23-2) is a chemical compound with molecular formula C18H11ClN2O3S2 and molecular weight 401.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-1,3-benzothiazole-6-carboxylate
Also Known As: methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)benzo[d]thiazole-6-carboxylate, methyl 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-1,3-benzothiazole-6-carboxylate, Methyl 2-[(3-chlorobenzothiophene-2-carbonyl)amino]benzothiazole-6-carboxylate, methyl 2-{[(3-chloro-1-benzothien-2-yl)carbonyl]amino}-1,3-benzothiazole-6-carboxylate, methyl 2-{[(3-chloro-1-benzothiophen-2-yl)carbonyl]amino}-1,3-benzothiazole-6-carboxylate
| Molecular Formula | C18H11ClN2O3S2 |
|---|---|
| Molecular Weight | 401.99 g/mol |
| LogP | 5.2033 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 401.98996 |
| Heavy Atoms | 26 |
| Complexity | 1165.8859 |
Chemical Identifiers
| CAS Number | 888409-23-2 |
|---|---|
| SMILES | COC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl |
Product Overview
Methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)benzo[d]thiazole-6-carboxylate (CAS 888409-23-2), with molecular formula C18H11ClN2O3S2 and molecular weight 401.99 g/mol. IUPAC: methyl 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-1,3-benzothiazole-6-carboxylate.
Chemical Property Profile of Methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)benzo[d]thiazole-6-carboxylate
Property Insights of Methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)benzo[d]thiazole-6-carboxylate
The XLogP value of 5.2033 indicates that Methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)benzo[d]thiazole-6-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)benzo[d]thiazole-6-carboxylate. Following Lipinski's Rule of Five, Methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)benzo[d]thiazole-6-carboxylate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)benzo[d]thiazole-6-carboxylate?
The CAS number of Methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)benzo[d]thiazole-6-carboxylate is 888409-23-2.
What is the molecular formula of Methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)benzo[d]thiazole-6-carboxylate?
The molecular formula of Methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)benzo[d]thiazole-6-carboxylate is C18H11ClN2O3S2.
What is the molecular weight of Methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)benzo[d]thiazole-6-carboxylate?
The molecular weight of Methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)benzo[d]thiazole-6-carboxylate is 401.99 g/mol.
Where can I buy Methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)benzo[d]thiazole-6-carboxylate?
You can request a quote for Methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)benzo[d]thiazole-6-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)benzo[d]thiazole-6-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)benzo[d]thiazole-6-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.