1-Phenyl-3-(pyridin-3-ylmethylideneamino)thiourea
TL;DR: 1-Phenyl-3-(pyridin-3-ylmethylideneamino)thiourea (CAS 67526-46-9) is a chemical compound with molecular formula C13H12N4S and molecular weight 256.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-3-(pyridin-3-ylmethylideneamino)thiourea
Also Known As: 1-phenyl-3-(pyridin-3-ylmethylideneamino)thiourea, 1-(3-pyridylmethylene)-4-phenyl-3-thiosemicarbazide
| Molecular Formula | C13H12N4S |
|---|---|
| Molecular Weight | 256.08 g/mol |
| LogP | 2.4021 |
| Topological Polar Surface Area | 49.31 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 256.07828 |
| Heavy Atoms | 18 |
| Complexity | 525.2022 |
Chemical Identifiers
| CAS Number | 67526-46-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=S)NN=CC2=CN=CC=C2 |
Product Overview
1-Phenyl-3-(pyridin-3-ylmethylideneamino)thiourea (CAS 67526-46-9), with molecular formula C13H12N4S and molecular weight 256.08 g/mol. IUPAC: 1-phenyl-3-(pyridin-3-ylmethylideneamino)thiourea.
Chemical Property Profile of 1-Phenyl-3-(pyridin-3-ylmethylideneamino)thiourea
Property Insights of 1-Phenyl-3-(pyridin-3-ylmethylideneamino)thiourea
The XLogP value of 2.4021 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Phenyl-3-(pyridin-3-ylmethylideneamino)thiourea. With a topological polar surface area (TPSA) of 49.31 Ų, 1-Phenyl-3-(pyridin-3-ylmethylideneamino)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Phenyl-3-(pyridin-3-ylmethylideneamino)thiourea 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 1-Phenyl-3-(pyridin-3-ylmethylideneamino)thiourea?
The CAS number of 1-Phenyl-3-(pyridin-3-ylmethylideneamino)thiourea is 67526-46-9.
What is the molecular formula of 1-Phenyl-3-(pyridin-3-ylmethylideneamino)thiourea?
The molecular formula of 1-Phenyl-3-(pyridin-3-ylmethylideneamino)thiourea is C13H12N4S.
What is the molecular weight of 1-Phenyl-3-(pyridin-3-ylmethylideneamino)thiourea?
The molecular weight of 1-Phenyl-3-(pyridin-3-ylmethylideneamino)thiourea is 256.08 g/mol.
Where can I buy 1-Phenyl-3-(pyridin-3-ylmethylideneamino)thiourea?
You can request a quote for 1-Phenyl-3-(pyridin-3-ylmethylideneamino)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenyl-3-(pyridin-3-ylmethylideneamino)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenyl-3-(pyridin-3-ylmethylideneamino)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.