A1432/0063626
TL;DR: A1432/0063626 (CAS 324531-77-3) is a chemical compound with molecular formula C18H12ClN9O4 and molecular weight 453.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-(4-chlorophenyl)methylideneamino]-5-(3-nitrophenyl)triazole-4-carboxamide
Also Known As: A1432/0063626, 1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-(4-chlorophenyl)methylideneamino]-5-(3-nitrophenyl)triazole-4-carboxamide, 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(4-chlorobenzylidene)-5-{3-nitrophenyl}-1H-1,2,3-triazole-4-carbohydrazide, 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-chlorophenyl)methylidene]-5-(3-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
| Molecular Formula | C18H12ClN9O4 |
|---|---|
| Molecular Weight | 453.07 g/mol |
| LogP | 2.225 |
| Topological Polar Surface Area | 180.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 453.07007 |
| Heavy Atoms | 32 |
| Complexity | 1330.4862 |
Chemical Identifiers
| CAS Number | 324531-77-3 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C2=C(N=NN2C3=NON=C3N)C(=O)N/N=C/C4=CC=C(C=C4)Cl |
Product Overview
A1432/0063626 (CAS 324531-77-3), with molecular formula C18H12ClN9O4 and molecular weight 453.07 g/mol. IUPAC: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-(4-chlorophenyl)methylideneamino]-5-(3-nitrophenyl)triazole-4-carboxamide.
Chemical Property Profile of A1432/0063626
Property Insights of A1432/0063626
The XLogP value of 2.225 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A1432/0063626. The TPSA of 180.25 Ų indicates high polarity, suggesting A1432/0063626 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, A1432/0063626 has 2 hydrogen bond donor(s) and 10 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 A1432/0063626?
The CAS number of A1432/0063626 is 324531-77-3.
What is the molecular formula of A1432/0063626?
The molecular formula of A1432/0063626 is C18H12ClN9O4.
What is the molecular weight of A1432/0063626?
The molecular weight of A1432/0063626 is 453.07 g/mol.
Where can I buy A1432/0063626?
You can request a quote for A1432/0063626 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1432/0063626?
Yes, KEHONG BIO provides custom synthesis services for A1432/0063626 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.