1-(1-Adamantylcarbonyl)thiosemicarbazide
TL;DR: 1-(1-Adamantylcarbonyl)thiosemicarbazide (CAS 40536-84-3) is a chemical compound with molecular formula C12H19N3OS and molecular weight 253.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(adamantane-1-carbonylamino)thiourea
Also Known As: Maybridge1_006381, (adamantane-1-carbonylamino)thiourea, 1-(1-adamantylcarbonyl)thiosemicarbazide, 1-(1-adamantylcarbonylamino)thiourea, [[1-adamantyl(oxo)methyl]amino]thiourea
| Molecular Formula | C12H19N3OS |
|---|---|
| Molecular Weight | 253.12 g/mol |
| LogP | 1.0672 |
| Topological Polar Surface Area | 67.15 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 253.12488 |
| Heavy Atoms | 17 |
| Complexity | 333.47803 |
Chemical Identifiers
| CAS Number | 40536-84-3 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)C(=O)NNC(=S)N |
Product Overview
1-(1-Adamantylcarbonyl)thiosemicarbazide (CAS 40536-84-3), with molecular formula C12H19N3OS and molecular weight 253.12 g/mol. IUPAC: (adamantane-1-carbonylamino)thiourea.
Chemical Property Profile of 1-(1-Adamantylcarbonyl)thiosemicarbazide
Property Insights of 1-(1-Adamantylcarbonyl)thiosemicarbazide
The XLogP value of 1.0672 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1-Adamantylcarbonyl)thiosemicarbazide. The TPSA of 67.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(1-Adamantylcarbonyl)thiosemicarbazide. Following Lipinski's Rule of Five, 1-(1-Adamantylcarbonyl)thiosemicarbazide has 3 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 1-(1-Adamantylcarbonyl)thiosemicarbazide?
The CAS number of 1-(1-Adamantylcarbonyl)thiosemicarbazide is 40536-84-3.
What is the molecular formula of 1-(1-Adamantylcarbonyl)thiosemicarbazide?
The molecular formula of 1-(1-Adamantylcarbonyl)thiosemicarbazide is C12H19N3OS.
What is the molecular weight of 1-(1-Adamantylcarbonyl)thiosemicarbazide?
The molecular weight of 1-(1-Adamantylcarbonyl)thiosemicarbazide is 253.12 g/mol.
Where can I buy 1-(1-Adamantylcarbonyl)thiosemicarbazide?
You can request a quote for 1-(1-Adamantylcarbonyl)thiosemicarbazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1-Adamantylcarbonyl)thiosemicarbazide?
Yes, KEHONG BIO provides custom synthesis services for 1-(1-Adamantylcarbonyl)thiosemicarbazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.