4-amino-N-(1,3-benzodioxol-5-ylmethylideneamino)benzenesulfonamide
TL;DR: 4-amino-N-(1,3-benzodioxol-5-ylmethylideneamino)benzenesulfonamide (CAS 5448-75-9) is a chemical compound with molecular formula C14H13N3O4S and molecular weight 319.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-N-(1,3-benzodioxol-5-ylmethylideneamino)benzenesulfonamide
Also Known As: 4-amino-N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]benzenes, 4-Amino-N'-(1,3-benzodioxol-5-ylmethylene)benzenesulfonohydrazide, 4-amino-N-(1,3-benzodioxol-5-ylmethylideneamino)benzenesulfonamide
| Molecular Formula | C14H13N3O4S |
|---|---|
| Molecular Weight | 319.06 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 319.06268 |
| Heavy Atoms | 22 |
| Complexity | 497.0 |
Chemical Identifiers
| CAS Number | 5448-75-9 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C=NNS(=O)(=O)C3=CC=C(C=C3)N |
| InChIKey | SLPFHVAXJGXOMS-UHFFFAOYSA-N |
Product Overview
4-amino-N-(1,3-benzodioxol-5-ylmethylideneamino)benzenesulfonamide (CAS 5448-75-9), with molecular formula C14H13N3O4S and molecular weight 319.06 g/mol. IUPAC: 4-amino-N-(1,3-benzodioxol-5-ylmethylideneamino)benzenesulfonamide.
Chemical Property Profile of 4-amino-N-(1,3-benzodioxol-5-ylmethylideneamino)benzenesulfonamide
Property Insights of 4-amino-N-(1,3-benzodioxol-5-ylmethylideneamino)benzenesulfonamide
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-amino-N-(1,3-benzodioxol-5-ylmethylideneamino)benzenesulfonamide. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-amino-N-(1,3-benzodioxol-5-ylmethylideneamino)benzenesulfonamide. Following Lipinski's Rule of Five, 4-amino-N-(1,3-benzodioxol-5-ylmethylideneamino)benzenesulfonamide 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 4-amino-N-(1,3-benzodioxol-5-ylmethylideneamino)benzenesulfonamide?
The CAS number of 4-amino-N-(1,3-benzodioxol-5-ylmethylideneamino)benzenesulfonamide is 5448-75-9.
What is the molecular formula of 4-amino-N-(1,3-benzodioxol-5-ylmethylideneamino)benzenesulfonamide?
The molecular formula of 4-amino-N-(1,3-benzodioxol-5-ylmethylideneamino)benzenesulfonamide is C14H13N3O4S.
What is the molecular weight of 4-amino-N-(1,3-benzodioxol-5-ylmethylideneamino)benzenesulfonamide?
The molecular weight of 4-amino-N-(1,3-benzodioxol-5-ylmethylideneamino)benzenesulfonamide is 319.06 g/mol.
Where can I buy 4-amino-N-(1,3-benzodioxol-5-ylmethylideneamino)benzenesulfonamide?
You can request a quote for 4-amino-N-(1,3-benzodioxol-5-ylmethylideneamino)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-amino-N-(1,3-benzodioxol-5-ylmethylideneamino)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-amino-N-(1,3-benzodioxol-5-ylmethylideneamino)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.