TL;DR: N-(9-Anthrylmethyl)-N'-benzoyl-N-methylthiourea (CAS 167781-43-3) is a chemical compound with molecular formula C24H20N2OS and molecular weight 384.12964 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[anthracen-9-ylmethyl(methyl)carbamothioyl]benzamide
Also Known As: N-(9-Anthrylmethyl)-N'-benzoyl-N-methylthiourea, N-[anthracen-9-ylmethyl(methyl)carbamothioyl]benzamide, N-(9-ANTHRYLMETHYL)-N-BENZOYL-N-METHYL-T, 1-(9-Anthrylmethyl)-1-methyl-3-benzoylthiourea, N-(9-Anthrylmethyl)-N/'-benzoyl-N-methylthiourea
| Molecular Formula | C24H20N2OS |
| Molecular Weight | 384.12964 g/mol |
| XLogP | 5.6 |
| Topological Polar Surface Area (TPSA) | 64.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 384.12964 Da |
| Heavy Atoms | 28 |
| Complexity | 537.0 |
| SMILES | CN(CC1=C2C=CC=CC2=CC3=CC=CC=C31)C(=S)NC(=O)C4=CC=CC=C4 |
| InChIKey | XYAXWYSMSAAWKE-UHFFFAOYSA-N |
The XLogP value of 5.6 indicates that N-(9-Anthrylmethyl)-N'-benzoyl-N-methylthiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(9-Anthrylmethyl)-N'-benzoyl-N-methylthiourea. Following Lipinski's Rule of Five, N-(9-Anthrylmethyl)-N'-benzoyl-N-methylthiourea has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of N-(9-Anthrylmethyl)-N'-benzoyl-N-methylthiourea is 167781-43-3.
The molecular formula of N-(9-Anthrylmethyl)-N'-benzoyl-N-methylthiourea is C24H20N2OS.
The molecular weight of N-(9-Anthrylmethyl)-N'-benzoyl-N-methylthiourea is 384.12964 g/mol.
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