3,7-dichloro-6-methoxy-N-propyl-1-benzothiophene-2-carboxamide
TL;DR: 3,7-dichloro-6-methoxy-N-propyl-1-benzothiophene-2-carboxamide (CAS 690669-98-8) is a chemical compound with molecular formula C13H13Cl2NO2S and molecular weight 317.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,7-dichloro-6-methoxy-N-propyl-1-benzothiophene-2-carboxamide
Also Known As: BAS 04296255, 3,7-dichloro-6-methoxy-N-propyl-1-benzothiophene-2-carboxamide, 3,7-Dichloro-6-methoxy-benzo[b]thiophene-2-carboxylic acid propylamide, Cambridge id 7025528
| Molecular Formula | C13H13Cl2NO2S |
|---|---|
| Molecular Weight | 317.00 g/mol |
| LogP | 4.3565 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 317.0044 |
| Heavy Atoms | 19 |
| Complexity | 624.62103 |
Chemical Identifiers
| CAS Number | 690669-98-8 |
|---|---|
| SMILES | CCCNC(=O)C1=C(C2=C(S1)C(=C(C=C2)OC)Cl)Cl |
Product Overview
3,7-dichloro-6-methoxy-N-propyl-1-benzothiophene-2-carboxamide (CAS 690669-98-8), with molecular formula C13H13Cl2NO2S and molecular weight 317.00 g/mol. IUPAC: 3,7-dichloro-6-methoxy-N-propyl-1-benzothiophene-2-carboxamide.
Chemical Property Profile of 3,7-dichloro-6-methoxy-N-propyl-1-benzothiophene-2-carboxamide
Property Insights of 3,7-dichloro-6-methoxy-N-propyl-1-benzothiophene-2-carboxamide
The XLogP value of 4.3565 indicates that 3,7-dichloro-6-methoxy-N-propyl-1-benzothiophene-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.33 Ų, 3,7-dichloro-6-methoxy-N-propyl-1-benzothiophene-2-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,7-dichloro-6-methoxy-N-propyl-1-benzothiophene-2-carboxamide has 1 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 3,7-dichloro-6-methoxy-N-propyl-1-benzothiophene-2-carboxamide?
The CAS number of 3,7-dichloro-6-methoxy-N-propyl-1-benzothiophene-2-carboxamide is 690669-98-8.
What is the molecular formula of 3,7-dichloro-6-methoxy-N-propyl-1-benzothiophene-2-carboxamide?
The molecular formula of 3,7-dichloro-6-methoxy-N-propyl-1-benzothiophene-2-carboxamide is C13H13Cl2NO2S.
What is the molecular weight of 3,7-dichloro-6-methoxy-N-propyl-1-benzothiophene-2-carboxamide?
The molecular weight of 3,7-dichloro-6-methoxy-N-propyl-1-benzothiophene-2-carboxamide is 317.00 g/mol.
Where can I buy 3,7-dichloro-6-methoxy-N-propyl-1-benzothiophene-2-carboxamide?
You can request a quote for 3,7-dichloro-6-methoxy-N-propyl-1-benzothiophene-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,7-dichloro-6-methoxy-N-propyl-1-benzothiophene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3,7-dichloro-6-methoxy-N-propyl-1-benzothiophene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.