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N-[(4-Chlorophenyl)carbamoyl]naphthalene-1-carbothioamide
TL;DR: N-[(4-Chlorophenyl)carbamoyl]naphthalene-1-carbothioamide (CAS 51933-53-0) is a chemical compound with molecular formula C18H13ClN2OS and molecular weight 340.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-3-(naphthalene-1-carbothioyl)urea
Also Known As: 1-(4-chlorophenyl)-3-(naphthalene-1-carbothioyl)urea, N-[(4-Chlorophenyl)carbamoyl]naphthalene-1-carbothioamide
| Molecular Formula | C18H13ClN2OS |
|---|---|
| Molecular Weight | 340.04 g/mol |
| LogP | 4.9904 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 340.0437 |
| Heavy Atoms | 23 |
| Complexity | 872.3338 |
Chemical Identifiers
| CAS Number | 51933-53-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2C(=S)NC(=O)NC3=CC=C(C=C3)Cl |
Product Overview
N-[(4-Chlorophenyl)carbamoyl]naphthalene-1-carbothioamide (CAS 51933-53-0), with molecular formula C18H13ClN2OS and molecular weight 340.04 g/mol. IUPAC: 1-(4-chlorophenyl)-3-(naphthalene-1-carbothioyl)urea.
Chemical Property Profile of N-[(4-Chlorophenyl)carbamoyl]naphthalene-1-carbothioamide
Property Insights of N-[(4-Chlorophenyl)carbamoyl]naphthalene-1-carbothioamide
The XLogP value of 4.9904 indicates that N-[(4-Chlorophenyl)carbamoyl]naphthalene-1-carbothioamide 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-[(4-Chlorophenyl)carbamoyl]naphthalene-1-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(4-Chlorophenyl)carbamoyl]naphthalene-1-carbothioamide 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-[(4-Chlorophenyl)carbamoyl]naphthalene-1-carbothioamide?
The CAS number of N-[(4-Chlorophenyl)carbamoyl]naphthalene-1-carbothioamide is 51933-53-0.
What is the molecular formula of N-[(4-Chlorophenyl)carbamoyl]naphthalene-1-carbothioamide?
The molecular formula of N-[(4-Chlorophenyl)carbamoyl]naphthalene-1-carbothioamide is C18H13ClN2OS.
What is the molecular weight of N-[(4-Chlorophenyl)carbamoyl]naphthalene-1-carbothioamide?
The molecular weight of N-[(4-Chlorophenyl)carbamoyl]naphthalene-1-carbothioamide is 340.04 g/mol.
Where can I buy N-[(4-Chlorophenyl)carbamoyl]naphthalene-1-carbothioamide?
You can request a quote for N-[(4-Chlorophenyl)carbamoyl]naphthalene-1-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(4-Chlorophenyl)carbamoyl]naphthalene-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(4-Chlorophenyl)carbamoyl]naphthalene-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.