4-(Pyren-1-ylmethylideneamino)-2,1,3-benzothiadiazol-5-amine
TL;DR: 4-(Pyren-1-ylmethylideneamino)-2,1,3-benzothiadiazol-5-amine (CAS 7231-75-6) is a chemical compound with molecular formula C23H14N4S and molecular weight 378.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(pyren-1-ylmethylideneamino)-2,1,3-benzothiadiazol-5-amine
Also Known As: J2.024.168C, 4-[(1-Pyrenyl)methyleneamino]-5-amino-2,1,3-benzothiadiazole, 4-(pyren-1-ylmethylideneamino)-2,1,3-benzothiadiazol-5-amine, 4-{(E)-[(Pyren-1-yl)methylidene]amino}-2,1,3-benzothiadiazol-5-amine, N4-[(PYREN-1-YL)METHYLIDENE]-2,1,3-BENZOTHIADIAZOLE-4,5-DIAMINE
| Molecular Formula | C23H14N4S |
|---|---|
| Molecular Weight | 378.09 g/mol |
| LogP | 5.9215 |
| Topological Polar Surface Area | 64.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 378.0939 |
| Heavy Atoms | 28 |
| Complexity | 1514.7561 |
Chemical Identifiers
| CAS Number | 7231-75-6 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)C=NC5=C(C=CC6=NSN=C65)N |
Product Overview
4-(Pyren-1-ylmethylideneamino)-2,1,3-benzothiadiazol-5-amine (CAS 7231-75-6), with molecular formula C23H14N4S and molecular weight 378.09 g/mol. IUPAC: 4-(pyren-1-ylmethylideneamino)-2,1,3-benzothiadiazol-5-amine.
Chemical Property Profile of 4-(Pyren-1-ylmethylideneamino)-2,1,3-benzothiadiazol-5-amine
Property Insights of 4-(Pyren-1-ylmethylideneamino)-2,1,3-benzothiadiazol-5-amine
The XLogP value of 5.9215 indicates that 4-(Pyren-1-ylmethylideneamino)-2,1,3-benzothiadiazol-5-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(Pyren-1-ylmethylideneamino)-2,1,3-benzothiadiazol-5-amine. Following Lipinski's Rule of Five, 4-(Pyren-1-ylmethylideneamino)-2,1,3-benzothiadiazol-5-amine has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(Pyren-1-ylmethylideneamino)-2,1,3-benzothiadiazol-5-amine?
The CAS number of 4-(Pyren-1-ylmethylideneamino)-2,1,3-benzothiadiazol-5-amine is 7231-75-6.
What is the molecular formula of 4-(Pyren-1-ylmethylideneamino)-2,1,3-benzothiadiazol-5-amine?
The molecular formula of 4-(Pyren-1-ylmethylideneamino)-2,1,3-benzothiadiazol-5-amine is C23H14N4S.
What is the molecular weight of 4-(Pyren-1-ylmethylideneamino)-2,1,3-benzothiadiazol-5-amine?
The molecular weight of 4-(Pyren-1-ylmethylideneamino)-2,1,3-benzothiadiazol-5-amine is 378.09 g/mol.
Where can I buy 4-(Pyren-1-ylmethylideneamino)-2,1,3-benzothiadiazol-5-amine?
You can request a quote for 4-(Pyren-1-ylmethylideneamino)-2,1,3-benzothiadiazol-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Pyren-1-ylmethylideneamino)-2,1,3-benzothiadiazol-5-amine?
Yes, KEHONG BIO provides custom synthesis services for 4-(Pyren-1-ylmethylideneamino)-2,1,3-benzothiadiazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.