Acetone thiosemicarbazide
TL;DR: Acetone thiosemicarbazide (CAS 41010-20-2) is a chemical compound with molecular formula C4H9N3S and molecular weight 131.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(propan-2-ylideneamino)thiourea
Also Known As: Acetone thiosemicarbazone, Acetonethiosemicarbazone, Thiosemicarbazone acetone, ACETONE THIOSEMICARBAZIDE, Acetone, thiosemicarbazone
| Molecular Formula | C4H9N3S |
|---|---|
| Molecular Weight | 131.05 g/mol |
| LogP | 0.2154 |
| Topological Polar Surface Area | 50.41 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 131.05171 |
| Heavy Atoms | 8 |
| Complexity | 114.45183 |
Chemical Identifiers
| CAS Number | 41010-20-2 |
|---|---|
| SMILES | CC(=NNC(=S)N)C |
Product Overview
Acetone thiosemicarbazide (CAS 41010-20-2), with molecular formula C4H9N3S and molecular weight 131.05 g/mol. IUPAC: (propan-2-ylideneamino)thiourea.
Chemical Property Profile of Acetone thiosemicarbazide
Property Insights of Acetone thiosemicarbazide
The XLogP value of 0.2154 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetone thiosemicarbazide. With a topological polar surface area (TPSA) of 50.41 Ų, Acetone thiosemicarbazide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetone thiosemicarbazide has 2 hydrogen bond donor(s) and 2 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 Acetone thiosemicarbazide?
The CAS number of Acetone thiosemicarbazide is 41010-20-2.
What is the molecular formula of Acetone thiosemicarbazide?
The molecular formula of Acetone thiosemicarbazide is C4H9N3S.
What is the molecular weight of Acetone thiosemicarbazide?
The molecular weight of Acetone thiosemicarbazide is 131.05 g/mol.
Where can I buy Acetone thiosemicarbazide?
You can request a quote for Acetone thiosemicarbazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetone thiosemicarbazide?
Yes, KEHONG BIO provides custom synthesis services for Acetone thiosemicarbazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.