4-(Dimethylamino)benzaldehyde N-phenylthiosemicarbazone
TL;DR: 4-(Dimethylamino)benzaldehyde N-phenylthiosemicarbazone (CAS 1332462-93-7) is a chemical compound with molecular formula C16H18N4S and molecular weight 298.1252 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(E)-[4-(dimethylamino)phenyl]methylideneamino]-3-phenylthiourea
Also Known As: 4-(Dimethylamino)benzaldehyde N-phenylthiosemicarbazone, J2.275.098D, p-((Dimethylamino)benzylidene)-4-phenyl-thiosemicarbazide, 1-[(E)-[4-(dimethylamino)phenyl]methylideneamino]-3-phenylthiourea, AN-689/40156649
Technical Specifications
| Molecular Formula | C16H18N4S |
| Molecular Weight | 298.1252 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 71.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 298.1252 Da |
| Heavy Atoms | 21 |
| Complexity | 342.0 |
| SMILES | CN(C)C1=CC=C(C=C1)/C=N/NC(=S)NC2=CC=CC=C2 |
| InChIKey | HBLLYJOWYYMLSE-SFQUDFHCSA-N |
Chemical Property Profile of 4-(Dimethylamino)benzaldehyde N-phenylthiosemicarbazone
Property Insights of 4-(Dimethylamino)benzaldehyde N-phenylthiosemicarbazone
The XLogP value of 3.3 indicates that 4-(Dimethylamino)benzaldehyde N-phenylthiosemicarbazone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(Dimethylamino)benzaldehyde N-phenylthiosemicarbazone. Following Lipinski's Rule of Five, 4-(Dimethylamino)benzaldehyde N-phenylthiosemicarbazone has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-(Dimethylamino)benzaldehyde N-phenylthiosemicarbazone?
The CAS number of 4-(Dimethylamino)benzaldehyde N-phenylthiosemicarbazone is 1332462-93-7.
What is the molecular formula of 4-(Dimethylamino)benzaldehyde N-phenylthiosemicarbazone?
The molecular formula of 4-(Dimethylamino)benzaldehyde N-phenylthiosemicarbazone is C16H18N4S.
What is the molecular weight of 4-(Dimethylamino)benzaldehyde N-phenylthiosemicarbazone?
The molecular weight of 4-(Dimethylamino)benzaldehyde N-phenylthiosemicarbazone is 298.1252 g/mol.
Where can I buy 4-(Dimethylamino)benzaldehyde N-phenylthiosemicarbazone?
You can request a quote for 4-(Dimethylamino)benzaldehyde N-phenylthiosemicarbazone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(Dimethylamino)benzaldehyde N-phenylthiosemicarbazone?
Yes, CoreyChem provides custom synthesis services for 4-(Dimethylamino)benzaldehyde N-phenylthiosemicarbazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.