2-hexadecoxy-5-[[(E)-(3-methyl-5-sulfo-1,3-benzothiazol-2-yl
TL;DR: 2-hexadecoxy-5-[[(E)-(3-methyl-5-sulfo-1,3-benzothiazol-2-yl (CAS 24096-78-4) is a chemical compound with molecular formula C31H45N3O8S3 and molecular weight 683.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hexadecoxy-5-[[(3-methyl-5-sulfo-1,3-benzothiazol-2-ylidene)amino]sulfamoyl]benzoic acid
Also Known As: 2-hexadecoxy-5-[[(E)-(3-methyl-5-sulfo-1,3-benzothiazol-2-yl, 2-hexadecoxy-5-[[(3-methyl-5-sulfo-1,3-benzothiazol-2-ylidene)amino]sulfamoyl]benzoic acid
| Molecular Formula | C31H45N3O8S3 |
|---|---|
| Molecular Weight | 683.24 g/mol |
| LogP | 9.0 |
| Topological Polar Surface Area | 205.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 21 |
| Exact Mass | 683.2369 |
| Heavy Atoms | 45 |
| Complexity | 1140.0 |
Chemical Identifiers
| CAS Number | 24096-78-4 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)S(=O)(=O)NN=C2N(C3=C(S2)C=CC(=C3)S(=O)(=O)O)C)C(=O)O |
| InChIKey | ADUYIQOMYWFWLL-UHFFFAOYSA-N |
Product Overview
2-hexadecoxy-5-[[(E)-(3-methyl-5-sulfo-1,3-benzothiazol-2-yl (CAS 24096-78-4), with molecular formula C31H45N3O8S3 and molecular weight 683.24 g/mol. IUPAC: 2-hexadecoxy-5-[[(3-methyl-5-sulfo-1,3-benzothiazol-2-ylidene)amino]sulfamoyl]benzoic acid.
Chemical Property Profile of 2-hexadecoxy-5-[[(E)-(3-methyl-5-sulfo-1,3-benzothiazol-2-yl
Property Insights of 2-hexadecoxy-5-[[(E)-(3-methyl-5-sulfo-1,3-benzothiazol-2-yl
The XLogP value of 9.0 indicates that 2-hexadecoxy-5-[[(E)-(3-methyl-5-sulfo-1,3-benzothiazol-2-yl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 205.0 Ų indicates high polarity, suggesting 2-hexadecoxy-5-[[(E)-(3-methyl-5-sulfo-1,3-benzothiazol-2-yl may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-hexadecoxy-5-[[(E)-(3-methyl-5-sulfo-1,3-benzothiazol-2-yl has 3 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-hexadecoxy-5-[[(E)-(3-methyl-5-sulfo-1,3-benzothiazol-2-yl?
The CAS number of 2-hexadecoxy-5-[[(E)-(3-methyl-5-sulfo-1,3-benzothiazol-2-yl is 24096-78-4.
What is the molecular formula of 2-hexadecoxy-5-[[(E)-(3-methyl-5-sulfo-1,3-benzothiazol-2-yl?
The molecular formula of 2-hexadecoxy-5-[[(E)-(3-methyl-5-sulfo-1,3-benzothiazol-2-yl is C31H45N3O8S3.
What is the molecular weight of 2-hexadecoxy-5-[[(E)-(3-methyl-5-sulfo-1,3-benzothiazol-2-yl?
The molecular weight of 2-hexadecoxy-5-[[(E)-(3-methyl-5-sulfo-1,3-benzothiazol-2-yl is 683.24 g/mol.
Where can I buy 2-hexadecoxy-5-[[(E)-(3-methyl-5-sulfo-1,3-benzothiazol-2-yl?
You can request a quote for 2-hexadecoxy-5-[[(E)-(3-methyl-5-sulfo-1,3-benzothiazol-2-yl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-hexadecoxy-5-[[(E)-(3-methyl-5-sulfo-1,3-benzothiazol-2-yl?
Yes, KEHONG BIO provides custom synthesis services for 2-hexadecoxy-5-[[(E)-(3-methyl-5-sulfo-1,3-benzothiazol-2-yl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.