F0331-0115
TL;DR: F0331-0115 (CAS 64117-37-9) is a chemical compound with molecular formula C18H19N5OS and molecular weight 353.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-benzimidazol-2-ylsulfanyl)-N-[(Z)-[4-(dimethylamino)phenyl]methylideneamino]acetamide
Also Known As: F0331-0115, (Z)-2-((1H-benzo[d]imidazol-2-yl)thio)-N'-(4-(dimethylamino)benzylidene)acetohydrazide, 2-(1H-benzimidazol-2-ylsulfanyl)-N-[(Z)-(4-dimethylaminophenyl)methylideneamino]acetamide, 2-(1H-benzimidazol-2-ylsulfanyl)-N-[(Z)-[4-(dimethylamino)phenyl]methylideneamino]acetamide, 2-(1H-1,3-BENZODIAZOL-2-YLSULFANYL)-N'-[(1Z)-[4-(DIMETHYLAMINO)PHENYL]METHYLIDENE]ACETOHYDRAZIDE
| Molecular Formula | C18H19N5OS |
|---|---|
| Molecular Weight | 353.13 g/mol |
| LogP | 2.8713 |
| Topological Polar Surface Area | 73.38 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 353.13104 |
| Heavy Atoms | 25 |
| Complexity | 852.8776 |
Chemical Identifiers
| CAS Number | 64117-37-9 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)/C=N\NC(=O)CSC2=NC3=CC=CC=C3N2 |
Product Overview
F0331-0115 (CAS 64117-37-9), with molecular formula C18H19N5OS and molecular weight 353.13 g/mol. IUPAC: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[(Z)-[4-(dimethylamino)phenyl]methylideneamino]acetamide.
Chemical Property Profile of F0331-0115
Property Insights of F0331-0115
The XLogP value of 2.8713 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0331-0115. The TPSA of 73.38 Ų falls within the moderate polarity range, balancing permeability and solubility for F0331-0115. Following Lipinski's Rule of Five, F0331-0115 has 2 hydrogen bond donor(s) and 5 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 F0331-0115?
The CAS number of F0331-0115 is 64117-37-9.
What is the molecular formula of F0331-0115?
The molecular formula of F0331-0115 is C18H19N5OS.
What is the molecular weight of F0331-0115?
The molecular weight of F0331-0115 is 353.13 g/mol.
Where can I buy F0331-0115?
You can request a quote for F0331-0115 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0331-0115?
Yes, KEHONG BIO provides custom synthesis services for F0331-0115 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.