Benzo(b)thiophene-6-carboxamidine, 2-(p-amidinophenyl)-, dihydrochloride
TL;DR: Benzo(b)thiophene-6-carboxamidine, 2-(p-amidinophenyl)-, dihydrochloride (CAS 4816-13-1) is a chemical compound with molecular formula C16H16Cl2N4S and molecular weight 366.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-carbamimidoylphenyl)-1-benzothiophene-6-carboximidamide;dihydrochloride
Also Known As: 2-(p-Amidinophenyl)benzo(b)thiophene-6-carboxamidine dihydrochloride, Benzo(b)thiophene-6-carboxamidine, 2-(p-amidinophenyl)-, dihydrochloride, 2-(4-carbamimidoylphenyl)-1-benzothiophene-6-carboximidamide dihydrochloride, 2-(4-Carbamimidoylphenyl)-1-benzothiophene-6-carboximidamide--hydrogen chloride (1/2)
| Molecular Formula | C16H16Cl2N4S |
|---|---|
| Molecular Weight | 366.05 g/mol |
| LogP | 3.98004 |
| Topological Polar Surface Area | 99.74 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 366.04727 |
| Heavy Atoms | 23 |
| Complexity | 856.14764 |
Chemical Identifiers
| CAS Number | 4816-13-1 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=CC3=C(S2)C=C(C=C3)C(=N)N)C(=N)N.Cl.Cl |
Product Overview
Benzo(b)thiophene-6-carboxamidine, 2-(p-amidinophenyl)-, dihydrochloride (CAS 4816-13-1), with molecular formula C16H16Cl2N4S and molecular weight 366.05 g/mol. IUPAC: 2-(4-carbamimidoylphenyl)-1-benzothiophene-6-carboximidamide;dihydrochloride.
Chemical Property Profile of Benzo(b)thiophene-6-carboxamidine, 2-(p-amidinophenyl)-, dihydrochloride
Property Insights of Benzo(b)thiophene-6-carboxamidine, 2-(p-amidinophenyl)-, dihydrochloride
The XLogP value of 3.98004 indicates that Benzo(b)thiophene-6-carboxamidine, 2-(p-amidinophenyl)-, dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.74 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzo(b)thiophene-6-carboxamidine, 2-(p-amidinophenyl)-, dihydrochloride. Following Lipinski's Rule of Five, Benzo(b)thiophene-6-carboxamidine, 2-(p-amidinophenyl)-, dihydrochloride has 4 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 Benzo(b)thiophene-6-carboxamidine, 2-(p-amidinophenyl)-, dihydrochloride?
The CAS number of Benzo(b)thiophene-6-carboxamidine, 2-(p-amidinophenyl)-, dihydrochloride is 4816-13-1.
What is the molecular formula of Benzo(b)thiophene-6-carboxamidine, 2-(p-amidinophenyl)-, dihydrochloride?
The molecular formula of Benzo(b)thiophene-6-carboxamidine, 2-(p-amidinophenyl)-, dihydrochloride is C16H16Cl2N4S.
What is the molecular weight of Benzo(b)thiophene-6-carboxamidine, 2-(p-amidinophenyl)-, dihydrochloride?
The molecular weight of Benzo(b)thiophene-6-carboxamidine, 2-(p-amidinophenyl)-, dihydrochloride is 366.05 g/mol.
Where can I buy Benzo(b)thiophene-6-carboxamidine, 2-(p-amidinophenyl)-, dihydrochloride?
You can request a quote for Benzo(b)thiophene-6-carboxamidine, 2-(p-amidinophenyl)-, dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzo(b)thiophene-6-carboxamidine, 2-(p-amidinophenyl)-, dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Benzo(b)thiophene-6-carboxamidine, 2-(p-amidinophenyl)-, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.