![methyl 4-cyano-5-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate structure](/static/products/7659/765926-29-2.webp)
methyl 4-cyano-5-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate
TL;DR: methyl 4-cyano-5-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate (CAS 765926-29-2) is a chemical compound with molecular formula C17H10Cl2N2O3S2 and molecular weight 423.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-cyano-5-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate
Also Known As: methyl 4-cyano-5-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate, methyl 4-cyano-5-{[(3,6-dichloro-1-benzothiophen-2-yl)carbonyl]amino}-3-methylthiophene-2-carboxylate, methyl 4-cyano-5-(3,6-dichlorobenzo[b]thiophene-2-carboxamido)-3-methylthiophene-2-carboxylate, Methyl 4-cyano-5-[(3,6-dichlorobenzothiophene-2-carbonyl)amino]-3-methyl-thiophene-2-carboxylate
| Molecular Formula | C17H10Cl2N2O3S2 |
|---|---|
| Molecular Weight | 423.95 g/mol |
| LogP | 5.4886 |
| Topological Polar Surface Area | 79.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 423.951 |
| Heavy Atoms | 26 |
| Complexity | 1095.7971 |
Chemical Identifiers
| CAS Number | 765926-29-2 |
|---|---|
| SMILES | CC1=C(SC(=C1C#N)NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl)C(=O)OC |
Product Overview
methyl 4-cyano-5-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate (CAS 765926-29-2), with molecular formula C17H10Cl2N2O3S2 and molecular weight 423.95 g/mol. IUPAC: methyl 4-cyano-5-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate.
Chemical Property Profile of methyl 4-cyano-5-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate
Property Insights of methyl 4-cyano-5-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate
The XLogP value of 5.4886 indicates that methyl 4-cyano-5-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.19 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 4-cyano-5-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate. Following Lipinski's Rule of Five, methyl 4-cyano-5-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-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 4-cyano-5-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate?
The CAS number of methyl 4-cyano-5-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate is 765926-29-2.
What is the molecular formula of methyl 4-cyano-5-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate?
The molecular formula of methyl 4-cyano-5-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate is C17H10Cl2N2O3S2.
What is the molecular weight of methyl 4-cyano-5-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate?
The molecular weight of methyl 4-cyano-5-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate is 423.95 g/mol.
Where can I buy methyl 4-cyano-5-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate?
You can request a quote for methyl 4-cyano-5-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 4-cyano-5-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 4-cyano-5-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.