ChemDiv1_002651
TL;DR: ChemDiv1_002651 (CAS 330190-85-7) is a chemical compound with molecular formula C21H23N5O7S2 and molecular weight 521.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[bis(2-methoxyethyl)sulfamoyl]-N-[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]benzamide
Also Known As: ChemDiv1_002651, 4-[bis(2-methoxyethyl)sulfamoyl]-N-[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]benzamide, F0326-0748, 4-(N,N-bis(2-methoxyethyl)sulfamoyl)-N-(5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl)benzamide
| Molecular Formula | C21H23N5O7S2 |
|---|---|
| Molecular Weight | 521.10 g/mol |
| LogP | 2.6491 |
| Topological Polar Surface Area | 153.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 12 |
| Exact Mass | 521.1039 |
| Heavy Atoms | 35 |
| Complexity | 1271.2253 |
Chemical Identifiers
| CAS Number | 330190-85-7 |
|---|---|
| SMILES | COCCN(CCOC)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=NN=C(S2)C3=CC(=CC=C3)[N+](=O)[O-] |
Product Overview
ChemDiv1_002651 (CAS 330190-85-7), with molecular formula C21H23N5O7S2 and molecular weight 521.10 g/mol. IUPAC: 4-[bis(2-methoxyethyl)sulfamoyl]-N-[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]benzamide.
Chemical Property Profile of ChemDiv1_002651
Property Insights of ChemDiv1_002651
The XLogP value of 2.6491 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_002651. The TPSA of 153.86 Ų indicates high polarity, suggesting ChemDiv1_002651 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ChemDiv1_002651 has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_002651?
The CAS number of ChemDiv1_002651 is 330190-85-7.
What is the molecular formula of ChemDiv1_002651?
The molecular formula of ChemDiv1_002651 is C21H23N5O7S2.
What is the molecular weight of ChemDiv1_002651?
The molecular weight of ChemDiv1_002651 is 521.10 g/mol.
Where can I buy ChemDiv1_002651?
You can request a quote for ChemDiv1_002651 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_002651?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_002651 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.