4-(N,N-diethylamino)benzaldehyde thiosemicarbazone
TL;DR: 4-(N,N-diethylamino)benzaldehyde thiosemicarbazone (CAS 18300-67-9) is a chemical compound with molecular formula C12H18N4S and molecular weight 250.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[4-(diethylamino)phenyl]methylideneamino]thiourea
Also Known As: 4-diethylamino-benzaldehyde thiosemicarbazone, 4-(N,N-diethylamino)benzaldehyde thiosemicarbazone, [[4-(diethylamino)phenyl]methylideneamino]thiourea
| Molecular Formula | C12H18N4S |
|---|---|
| Molecular Weight | 250.13 g/mol |
| LogP | 1.6999 |
| Topological Polar Surface Area | 53.65 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 250.12521 |
| Heavy Atoms | 17 |
| Complexity | 381.99704 |
Chemical Identifiers
| CAS Number | 18300-67-9 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)C=NNC(=S)N |
Product Overview
4-(N,N-diethylamino)benzaldehyde thiosemicarbazone (CAS 18300-67-9), with molecular formula C12H18N4S and molecular weight 250.13 g/mol. IUPAC: [[4-(diethylamino)phenyl]methylideneamino]thiourea.
Chemical Property Profile of 4-(N,N-diethylamino)benzaldehyde thiosemicarbazone
Property Insights of 4-(N,N-diethylamino)benzaldehyde thiosemicarbazone
The XLogP value of 1.6999 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(N,N-diethylamino)benzaldehyde thiosemicarbazone. With a topological polar surface area (TPSA) of 53.65 Ų, 4-(N,N-diethylamino)benzaldehyde thiosemicarbazone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(N,N-diethylamino)benzaldehyde thiosemicarbazone 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
Frequently Asked Questions
What is the CAS number of 4-(N,N-diethylamino)benzaldehyde thiosemicarbazone?
The CAS number of 4-(N,N-diethylamino)benzaldehyde thiosemicarbazone is 18300-67-9.
What is the molecular formula of 4-(N,N-diethylamino)benzaldehyde thiosemicarbazone?
The molecular formula of 4-(N,N-diethylamino)benzaldehyde thiosemicarbazone is C12H18N4S.
What is the molecular weight of 4-(N,N-diethylamino)benzaldehyde thiosemicarbazone?
The molecular weight of 4-(N,N-diethylamino)benzaldehyde thiosemicarbazone is 250.13 g/mol.
Where can I buy 4-(N,N-diethylamino)benzaldehyde thiosemicarbazone?
You can request a quote for 4-(N,N-diethylamino)benzaldehyde thiosemicarbazone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(N,N-diethylamino)benzaldehyde thiosemicarbazone?
Yes, KEHONG BIO provides custom synthesis services for 4-(N,N-diethylamino)benzaldehyde thiosemicarbazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.