RefChem:315266
TL;DR: RefChem:315266 (CAS 109193-29-5) is a chemical compound with molecular formula C19H20ClN9O5S2 and molecular weight 553.0717 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[4-[(E)-[amino-[[(E)-N'-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]carbamimidoyl]amino]methylidene]amino]sulfonyl-2-methylphenyl]acetamide;hydrochloride
Also Known As: Acetamide, N-(4-(((imino((imino((5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl)amino)methyl)amino)methyl)amino)sulfonyl)-2-methylphenyl)-, monohydrochloride, N-(4-{[(E)-Amino({N'-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]carbamimidoyl}amino)methylidene]sulfamoyl}-2-methylphenyl)acetamide--hydrogen chloride (1/1)
Technical Specifications
| Molecular Formula | C19H20ClN9O5S2 |
| Molecular Weight | 553.0717 g/mol |
| XLogP | 2.04132 |
| Topological Polar Surface Area (TPSA) | 260.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 553.0717 Da |
| Heavy Atoms | 36 |
| Complexity | 941.0 |
| SMILES | CC1=C(C=CC(=C1)S(=O)(=O)/N=C(\N)/N/C(=N/C2=NN=C(S2)C3=CC=C(C=C3)[N+](=O)[O-])/N)NC(=O)C.Cl |
| InChIKey | WKCSBDADBONSRE-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:315266
Property Insights of RefChem:315266
The XLogP value of 2.04132 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:315266. The TPSA of 260.0 Ų indicates high polarity, suggesting RefChem:315266 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:315266 has 5 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:315266?
The CAS number of RefChem:315266 is 109193-29-5.
What is the molecular formula of RefChem:315266?
The molecular formula of RefChem:315266 is C19H20ClN9O5S2.
What is the molecular weight of RefChem:315266?
The molecular weight of RefChem:315266 is 553.0717 g/mol.
Where can I buy RefChem:315266?
You can request a quote for RefChem:315266 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:315266?
Yes, CoreyChem provides custom synthesis services for RefChem:315266 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.