TL;DR: N-isopropyl-N'-[3-(1-naphthyl)acryloyl]thiourea (CAS 1164479-93-9) is a chemical compound with molecular formula C17H18N2OS and molecular weight 298.11398 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-3-naphthalen-1-yl-N-(propan-2-ylcarbamothioyl)prop-2-enamide
Also Known As: N-isopropyl-N'-[3-(1-naphthyl)acryloyl]thiourea, AN-329/42581102, N-Isopropyl-N/'-[3-(1-naphthyl)acryloyl]thiourea, (E)-3-naphthalen-1-yl-N-(propan-2-ylcarbamothioyl)prop-2-enamide, N-[(isopropylamino)carbonothioyl]-3-(1-naphthyl)acrylamide
| Molecular Formula | C17H18N2OS |
| Molecular Weight | 298.11398 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 73.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.11398 Da |
| Heavy Atoms | 21 |
| Complexity | 406.0 |
| SMILES | CC(C)NC(=S)NC(=O)/C=C/C1=CC=CC2=CC=CC=C21 |
| InChIKey | CDVRDZLULWGINS-ZHACJKMWSA-N |
The XLogP value of 4.4 indicates that N-isopropyl-N'-[3-(1-naphthyl)acryloyl]thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-isopropyl-N'-[3-(1-naphthyl)acryloyl]thiourea. Following Lipinski's Rule of Five, N-isopropyl-N'-[3-(1-naphthyl)acryloyl]thiourea has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-isopropyl-N'-[3-(1-naphthyl)acryloyl]thiourea is 1164479-93-9.
The molecular formula of N-isopropyl-N'-[3-(1-naphthyl)acryloyl]thiourea is C17H18N2OS.
The molecular weight of N-isopropyl-N'-[3-(1-naphthyl)acryloyl]thiourea is 298.11398 g/mol.
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