N-(phenylcarbamothioyl)adamantane-1-carboxamide
TL;DR: N-(phenylcarbamothioyl)adamantane-1-carboxamide (CAS 54979-90-7) is a chemical compound with molecular formula C18H22N2OS and molecular weight 314.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(phenylcarbamothioyl)adamantane-1-carboxamide
Also Known As: BIM-0015929.P001, N-(phenylcarbamothioyl)adamantane-1-carboxamide, N-(anilinocarbonothioyl)adamantane-1-carboxamide, N-(1-ADAMANTYLCARBONYL)-N'-PHENYLTHIOUREA, adamantanyl-N-[(phenylamino)thioxomethyl]carboxamide
| Molecular Formula | C18H22N2OS |
|---|---|
| Molecular Weight | 314.15 g/mol |
| LogP | 3.716 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 314.1453 |
| Heavy Atoms | 22 |
| Complexity | 563.0803 |
Chemical Identifiers
| CAS Number | 54979-90-7 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)C(=O)NC(=S)NC4=CC=CC=C4 |
Product Overview
N-(phenylcarbamothioyl)adamantane-1-carboxamide (CAS 54979-90-7), with molecular formula C18H22N2OS and molecular weight 314.15 g/mol. IUPAC: N-(phenylcarbamothioyl)adamantane-1-carboxamide.
Chemical Property Profile of N-(phenylcarbamothioyl)adamantane-1-carboxamide
Property Insights of N-(phenylcarbamothioyl)adamantane-1-carboxamide
The XLogP value of 3.716 indicates that N-(phenylcarbamothioyl)adamantane-1-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, N-(phenylcarbamothioyl)adamantane-1-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(phenylcarbamothioyl)adamantane-1-carboxamide 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 N-(phenylcarbamothioyl)adamantane-1-carboxamide?
The CAS number of N-(phenylcarbamothioyl)adamantane-1-carboxamide is 54979-90-7.
What is the molecular formula of N-(phenylcarbamothioyl)adamantane-1-carboxamide?
The molecular formula of N-(phenylcarbamothioyl)adamantane-1-carboxamide is C18H22N2OS.
What is the molecular weight of N-(phenylcarbamothioyl)adamantane-1-carboxamide?
The molecular weight of N-(phenylcarbamothioyl)adamantane-1-carboxamide is 314.15 g/mol.
Where can I buy N-(phenylcarbamothioyl)adamantane-1-carboxamide?
You can request a quote for N-(phenylcarbamothioyl)adamantane-1-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(phenylcarbamothioyl)adamantane-1-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(phenylcarbamothioyl)adamantane-1-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.