A1307/0059460
TL;DR: A1307/0059460 (CAS 339322-38-2) is a chemical compound with molecular formula C19H11N5O6S2 and molecular weight 469.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-[3-nitro-4-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]phenyl]methylideneamino]furan-2-carboxamide
Also Known As: A1307/0059460, N'-[(E)-{3-nitro-4-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]phenyl}methylidene]furan-2-carbohydrazide, (E)-N'-(3-nitro-4-((6-nitrobenzo[d]thiazol-2-yl)thio)benzylidene)furan-2-carbohydrazide, N'-[3-nitro-4-({6-nitro-1,3-benzothiazol-2-yl}sulfanyl)benzylidene]-2-furohydrazide, N-[(E)-[3-nitro-4-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]phenyl]methylideneamino]furan-2-carboxamide
| Molecular Formula | C19H11N5O6S2 |
|---|---|
| Molecular Weight | 469.02 g/mol |
| LogP | 4.6208 |
| Topological Polar Surface Area | 153.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 469.01508 |
| Heavy Atoms | 32 |
| Complexity | 1366.0607 |
Chemical Identifiers
| CAS Number | 339322-38-2 |
|---|---|
| SMILES | C1=COC(=C1)C(=O)N/N=C/C2=CC(=C(C=C2)SC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
A1307/0059460 (CAS 339322-38-2), with molecular formula C19H11N5O6S2 and molecular weight 469.02 g/mol. IUPAC: N-[(E)-[3-nitro-4-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]phenyl]methylideneamino]furan-2-carboxamide.
Chemical Property Profile of A1307/0059460
Property Insights of A1307/0059460
The XLogP value of 4.6208 indicates that A1307/0059460 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 153.77 Ų indicates high polarity, suggesting A1307/0059460 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, A1307/0059460 has 1 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 A1307/0059460?
The CAS number of A1307/0059460 is 339322-38-2.
What is the molecular formula of A1307/0059460?
The molecular formula of A1307/0059460 is C19H11N5O6S2.
What is the molecular weight of A1307/0059460?
The molecular weight of A1307/0059460 is 469.02 g/mol.
Where can I buy A1307/0059460?
You can request a quote for A1307/0059460 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1307/0059460?
Yes, KEHONG BIO provides custom synthesis services for A1307/0059460 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.