4-(3-Picolyl)-3-thiosemicarbazide
TL;DR: 4-(3-Picolyl)-3-thiosemicarbazide (CAS 76609-47-7) is a chemical compound with molecular formula C7H10N4S and molecular weight 182.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-amino-3-(pyridin-3-ylmethyl)thiourea
Also Known As: 4-(3-Picolyl)-3-thiosemicarbazide, 6-carboxy-fluorescein, N-(pyridin-3-ylmethyl)hydrazinecarbothioamide, 1-amino-3-(pyridin-3-ylmethyl)thiourea, 1-amino-3-(3-pyridinylmethyl)thiourea
| Molecular Formula | C7H10N4S |
|---|---|
| Molecular Weight | 182.06 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 95.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 182.06262 |
| Heavy Atoms | 12 |
| Complexity | 150.0 |
Chemical Identifiers
| CAS Number | 76609-47-7 |
|---|---|
| SMILES | C1=CC(=CN=C1)CNC(=S)NN |
| InChIKey | APBGERKKEPNJPX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(3-Picolyl)-3-thiosemicarbazide (CAS 76609-47-7), with molecular formula C7H10N4S and molecular weight 182.06 g/mol. IUPAC: 1-amino-3-(pyridin-3-ylmethyl)thiourea.
Chemical Property Profile of 4-(3-Picolyl)-3-thiosemicarbazide
Property Insights of 4-(3-Picolyl)-3-thiosemicarbazide
The XLogP value of -0.4 indicates that 4-(3-Picolyl)-3-thiosemicarbazide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 95.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(3-Picolyl)-3-thiosemicarbazide. Following Lipinski's Rule of Five, 4-(3-Picolyl)-3-thiosemicarbazide has 3 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-(3-Picolyl)-3-thiosemicarbazide?
The CAS number of 4-(3-Picolyl)-3-thiosemicarbazide is 76609-47-7.
What is the molecular formula of 4-(3-Picolyl)-3-thiosemicarbazide?
The molecular formula of 4-(3-Picolyl)-3-thiosemicarbazide is C7H10N4S.
What is the molecular weight of 4-(3-Picolyl)-3-thiosemicarbazide?
The molecular weight of 4-(3-Picolyl)-3-thiosemicarbazide is 182.06 g/mol.
Where can I buy 4-(3-Picolyl)-3-thiosemicarbazide?
You can request a quote for 4-(3-Picolyl)-3-thiosemicarbazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3-Picolyl)-3-thiosemicarbazide?
Yes, KEHONG BIO provides custom synthesis services for 4-(3-Picolyl)-3-thiosemicarbazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.