TL;DR: 1-(2,5-dimethoxyphenyl)-3-(1H-indol-3-yl)urea (CAS 941987-72-0) is a chemical compound with molecular formula C17H17N3O3 and molecular weight 311.12698 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2,5-dimethoxyphenyl)-3-(1H-indol-3-yl)urea
Also Known As: 1-(2,5-dimethoxyphenyl)-3-(1H-indol-3-yl)urea, F2740-0198
| Molecular Formula | C17H17N3O3 |
| Molecular Weight | 311.12698 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 75.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 311.12698 Da |
| Heavy Atoms | 23 |
| Complexity | 407.0 |
| SMILES | COC1=CC(=C(C=C1)OC)NC(=O)NC2=CNC3=CC=CC=C32 |
| InChIKey | GZPOUWXGNSFSPU-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,5-dimethoxyphenyl)-3-(1H-indol-3-yl)urea. The TPSA of 75.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,5-dimethoxyphenyl)-3-(1H-indol-3-yl)urea. Following Lipinski's Rule of Five, 1-(2,5-dimethoxyphenyl)-3-(1H-indol-3-yl)urea has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(2,5-dimethoxyphenyl)-3-(1H-indol-3-yl)urea is 941987-72-0.
The molecular formula of 1-(2,5-dimethoxyphenyl)-3-(1H-indol-3-yl)urea is C17H17N3O3.
The molecular weight of 1-(2,5-dimethoxyphenyl)-3-(1H-indol-3-yl)urea is 311.12698 g/mol.
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