1-((Carbamoylthiocarbonyl)amino)naphthalene
TL;DR: 1-((Carbamoylthiocarbonyl)amino)naphthalene (CAS 39785-45-0) is a chemical compound with molecular formula C12H10N2OS and molecular weight 230.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(naphthalen-1-ylamino)-2-sulfanylideneacetamide
Also Known As: 1-((Carbamoylthiocarbonyl)amino)naphthalene, 2-(1-Naphthylamino)-2-thioxoacetamide, 2-(1-Naphthylamino)-2-thioxoacetamide #, 2-(naphthalen-1-ylamino)-2-thioxoacetamide, J1.401.855G
| Molecular Formula | C12H10N2OS |
|---|---|
| Molecular Weight | 230.05 g/mol |
| LogP | 2.0644 |
| Topological Polar Surface Area | 55.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 230.05139 |
| Heavy Atoms | 16 |
| Complexity | 560.4523 |
Chemical Identifiers
| CAS Number | 39785-45-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2NC(=S)C(=O)N |
Product Overview
1-((Carbamoylthiocarbonyl)amino)naphthalene (CAS 39785-45-0), with molecular formula C12H10N2OS and molecular weight 230.05 g/mol. IUPAC: 2-(naphthalen-1-ylamino)-2-sulfanylideneacetamide.
Chemical Property Profile of 1-((Carbamoylthiocarbonyl)amino)naphthalene
Property Insights of 1-((Carbamoylthiocarbonyl)amino)naphthalene
The XLogP value of 2.0644 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-((Carbamoylthiocarbonyl)amino)naphthalene. With a topological polar surface area (TPSA) of 55.12 Ų, 1-((Carbamoylthiocarbonyl)amino)naphthalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-((Carbamoylthiocarbonyl)amino)naphthalene 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 1-((Carbamoylthiocarbonyl)amino)naphthalene?
The CAS number of 1-((Carbamoylthiocarbonyl)amino)naphthalene is 39785-45-0.
What is the molecular formula of 1-((Carbamoylthiocarbonyl)amino)naphthalene?
The molecular formula of 1-((Carbamoylthiocarbonyl)amino)naphthalene is C12H10N2OS.
What is the molecular weight of 1-((Carbamoylthiocarbonyl)amino)naphthalene?
The molecular weight of 1-((Carbamoylthiocarbonyl)amino)naphthalene is 230.05 g/mol.
Where can I buy 1-((Carbamoylthiocarbonyl)amino)naphthalene?
You can request a quote for 1-((Carbamoylthiocarbonyl)amino)naphthalene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-((Carbamoylthiocarbonyl)amino)naphthalene?
Yes, KEHONG BIO provides custom synthesis services for 1-((Carbamoylthiocarbonyl)amino)naphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.