EINECS 277-949-4
TL;DR: EINECS 277-949-4 (CAS 74651-65-3) is a chemical compound with molecular formula C16H26ClN3O5S and molecular weight 407.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dimethoxy-N-[(1-methylpyrrolidin-2-yl)methyl]-5-(methylsulfamoyl)benzamide;hydrochloride
Also Known As: EINECS 277-949-4, EINECS 277-947-3, 2,3-Dimethoxy-5-((methylamino)sulphonyl)-N-((1-methyl-2-pyrrolidinyl)methyl)benzamide monohydrochloride, 2,3-dimethoxy-5-[ sulphonyl]-N-[ methyl]benzamidemonohydrochloride, 2,3-Dimethoxy-N-[(1-methyl-2-pyrrolidinyl)methyl]-5-(methylsulfamoyl)benzamide hydrochloride
| Molecular Formula | C16H26ClN3O5S |
|---|---|
| Molecular Weight | 407.13 g/mol |
| LogP | 0.8577 |
| Topological Polar Surface Area | 96.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 407.12817 |
| Heavy Atoms | 26 |
| Complexity | 741.64594 |
Chemical Identifiers
| CAS Number | 74651-65-3 |
|---|---|
| SMILES | CNS(=O)(=O)C1=CC(=C(C(=C1)OC)OC)C(=O)NCC2CCCN2C.Cl |
Product Overview
EINECS 277-949-4 (CAS 74651-65-3), with molecular formula C16H26ClN3O5S and molecular weight 407.13 g/mol. IUPAC: 2,3-dimethoxy-N-[(1-methylpyrrolidin-2-yl)methyl]-5-(methylsulfamoyl)benzamide;hydrochloride.
Chemical Property Profile of EINECS 277-949-4
Property Insights of EINECS 277-949-4
The XLogP value of 0.8577 suggests moderate lipophilicity, balancing water solubility and membrane permeability for EINECS 277-949-4. The TPSA of 96.97 Ų falls within the moderate polarity range, balancing permeability and solubility for EINECS 277-949-4. Following Lipinski's Rule of Five, EINECS 277-949-4 has 2 hydrogen bond donor(s) and 6 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 EINECS 277-949-4?
The CAS number of EINECS 277-949-4 is 74651-65-3.
What is the molecular formula of EINECS 277-949-4?
The molecular formula of EINECS 277-949-4 is C16H26ClN3O5S.
What is the molecular weight of EINECS 277-949-4?
The molecular weight of EINECS 277-949-4 is 407.13 g/mol.
Where can I buy EINECS 277-949-4?
You can request a quote for EINECS 277-949-4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 277-949-4?
Yes, KEHONG BIO provides custom synthesis services for EINECS 277-949-4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.