RefChem:331678
TL;DR: RefChem:331678 (CAS 50673-10-4) is a chemical compound with molecular formula C18H17Cl2NO3S and molecular weight 397.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,2-dimethyl-3H-1-benzofuran-7-yl) N-(3,4-dichlorophenyl)sulfanyl-N-methylcarbamate
Also Known As: Carbamic acid, ((3,4-dichlorophenyl)thio)methyl-, 2,3-dihydro-2,2-dimethyl-7-benzofuranyl ester, (2,2-dimethyl-3H-1-benzofuran-7-yl) N-(3,4-dichlorophenyl)sulfanyl-N-methylcarbamate, 2,2-Dimethyl-2,3-dihydro-1-benzofuran-7-yl [(3,4-dichlorophenyl)sulfanyl](methyl)carbamate, RefChem:331678
| Molecular Formula | C18H17Cl2NO3S |
|---|---|
| Molecular Weight | 397.03 g/mol |
| LogP | 5.8448 |
| Topological Polar Surface Area | 38.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 397.0306 |
| Heavy Atoms | 25 |
| Complexity | 825.9636 |
Chemical Identifiers
| CAS Number | 50673-10-4 |
|---|---|
| SMILES | CC1(CC2=C(O1)C(=CC=C2)OC(=O)N(C)SC3=CC(=C(C=C3)Cl)Cl)C |
Product Overview
RefChem:331678 (CAS 50673-10-4), with molecular formula C18H17Cl2NO3S and molecular weight 397.03 g/mol. IUPAC: (2,2-dimethyl-3H-1-benzofuran-7-yl) N-(3,4-dichlorophenyl)sulfanyl-N-methylcarbamate.
Chemical Property Profile of RefChem:331678
Property Insights of RefChem:331678
The XLogP value of 5.8448 indicates that RefChem:331678 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.77 Ų, RefChem:331678 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:331678 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:331678?
The CAS number of RefChem:331678 is 50673-10-4.
What is the molecular formula of RefChem:331678?
The molecular formula of RefChem:331678 is C18H17Cl2NO3S.
What is the molecular weight of RefChem:331678?
The molecular weight of RefChem:331678 is 397.03 g/mol.
Where can I buy RefChem:331678?
You can request a quote for RefChem:331678 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:331678?
Yes, KEHONG BIO provides custom synthesis services for RefChem:331678 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.