RefChem:321779
TL;DR: RefChem:321779 (CAS 90763-27-2) is a chemical compound with molecular formula C18H30N4O4S and molecular weight 398.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(dimethylsulfamoylmethylamino)-N-[(1-ethylpyrrolidin-2-yl)methyl]-2-methoxybenzamide
Also Known As: N-((1-Ethyl-2-pyrrolidinyl)methyl)-2-methoxy-5-((dimethylsulfamoyl)methylamino)benzamide, Benzamide, 5-(((dimethylamino)sulfonyl)methylamino)-N-((1-ethyl-2-pyrrolidinyl)methyl)-2-methoxy-, 5-(dimethylsulfamoylmethylamino)-N-[(1-ethylpyrrolidin-2-yl)methyl]-2-methoxybenzamide, 5-{[(Dimethylsulfamoyl)methyl]amino}-N-[(1-ethylpyrrolidin-2-yl)methyl]-2-methoxybenzene-1-carboximidic acid, BRN 5631285
| Molecular Formula | C18H30N4O4S |
|---|---|
| Molecular Weight | 398.20 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 99.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 398.1988 |
| Heavy Atoms | 27 |
| Complexity | 578.0 |
Chemical Identifiers
| CAS Number | 90763-27-2 |
|---|---|
| SMILES | CCN1CCCC1CNC(=O)C2=C(C=CC(=C2)NCS(=O)(=O)N(C)C)OC |
| InChIKey | MOJVXEVFRZBHDK-UHFFFAOYSA-N |
Product Overview
RefChem:321779 (CAS 90763-27-2), with molecular formula C18H30N4O4S and molecular weight 398.20 g/mol. IUPAC: 5-(dimethylsulfamoylmethylamino)-N-[(1-ethylpyrrolidin-2-yl)methyl]-2-methoxybenzamide.
Chemical Property Profile of RefChem:321779
Property Insights of RefChem:321779
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:321779. The TPSA of 99.4 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:321779. Following Lipinski's Rule of Five, RefChem:321779 has 2 hydrogen bond donor(s) and 7 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 RefChem:321779?
The CAS number of RefChem:321779 is 90763-27-2.
What is the molecular formula of RefChem:321779?
The molecular formula of RefChem:321779 is C18H30N4O4S.
What is the molecular weight of RefChem:321779?
The molecular weight of RefChem:321779 is 398.20 g/mol.
Where can I buy RefChem:321779?
You can request a quote for RefChem:321779 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:321779?
Yes, KEHONG BIO provides custom synthesis services for RefChem:321779 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.