3-[[(E)-(4,6-dichloro-3-methyl-1,3-benzothiazol-2-ylidene)am
TL;DR: 3-[[(E)-(4,6-dichloro-3-methyl-1,3-benzothiazol-2-ylidene)am (CAS 24096-84-2) is a chemical compound with molecular formula C31H43Cl2N3O5S2 and molecular weight 671.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[(4,6-dichloro-3-methyl-1,3-benzothiazol-2-ylidene)amino]sulfamoyl]-4-hexadecoxybenzoic acid
Also Known As: 3-[[(E)-(4,6-dichloro-3-methyl-1,3-benzothiazol-2-ylidene)am, 3-[[(4,6-dichloro-3-methyl-1,3-benzothiazol-2-ylidene)amino]sulfamoyl]-4-hexadecoxybenzoic acid
| Molecular Formula | C31H43Cl2N3O5S2 |
|---|---|
| Molecular Weight | 671.20 g/mol |
| LogP | 11.5 |
| Topological Polar Surface Area | 142.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 20 |
| Exact Mass | 671.20215 |
| Heavy Atoms | 43 |
| Complexity | 968.0 |
Chemical Identifiers
| CAS Number | 24096-84-2 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NN=C2N(C3=C(S2)C=C(C=C3Cl)Cl)C |
| InChIKey | LHEROMPUMPHORR-UHFFFAOYSA-N |
Product Overview
3-[[(E)-(4,6-dichloro-3-methyl-1,3-benzothiazol-2-ylidene)am (CAS 24096-84-2), with molecular formula C31H43Cl2N3O5S2 and molecular weight 671.20 g/mol. IUPAC: 3-[[(4,6-dichloro-3-methyl-1,3-benzothiazol-2-ylidene)amino]sulfamoyl]-4-hexadecoxybenzoic acid.
Chemical Property Profile of 3-[[(E)-(4,6-dichloro-3-methyl-1,3-benzothiazol-2-ylidene)am
Property Insights of 3-[[(E)-(4,6-dichloro-3-methyl-1,3-benzothiazol-2-ylidene)am
The XLogP value of 11.5 indicates that 3-[[(E)-(4,6-dichloro-3-methyl-1,3-benzothiazol-2-ylidene)am is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 142.0 Ų indicates high polarity, suggesting 3-[[(E)-(4,6-dichloro-3-methyl-1,3-benzothiazol-2-ylidene)am may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-[[(E)-(4,6-dichloro-3-methyl-1,3-benzothiazol-2-ylidene)am has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[[(E)-(4,6-dichloro-3-methyl-1,3-benzothiazol-2-ylidene)am?
The CAS number of 3-[[(E)-(4,6-dichloro-3-methyl-1,3-benzothiazol-2-ylidene)am is 24096-84-2.
What is the molecular formula of 3-[[(E)-(4,6-dichloro-3-methyl-1,3-benzothiazol-2-ylidene)am?
The molecular formula of 3-[[(E)-(4,6-dichloro-3-methyl-1,3-benzothiazol-2-ylidene)am is C31H43Cl2N3O5S2.
What is the molecular weight of 3-[[(E)-(4,6-dichloro-3-methyl-1,3-benzothiazol-2-ylidene)am?
The molecular weight of 3-[[(E)-(4,6-dichloro-3-methyl-1,3-benzothiazol-2-ylidene)am is 671.20 g/mol.
Where can I buy 3-[[(E)-(4,6-dichloro-3-methyl-1,3-benzothiazol-2-ylidene)am?
You can request a quote for 3-[[(E)-(4,6-dichloro-3-methyl-1,3-benzothiazol-2-ylidene)am directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[[(E)-(4,6-dichloro-3-methyl-1,3-benzothiazol-2-ylidene)am?
Yes, KEHONG BIO provides custom synthesis services for 3-[[(E)-(4,6-dichloro-3-methyl-1,3-benzothiazol-2-ylidene)am and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.