7-(4-ethylpiperazine-1-carbonyl)-3-[(2-methoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
7-(4-ethylpiperazine-1-carbonyl)-3-[(2-methoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
7-(4-ethylpiperazine-1-carbonyl)-3-[(2-methoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K288-0580 |
| Compound Name: | 7-(4-ethylpiperazine-1-carbonyl)-3-[(2-methoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 438.55 |
| Molecular Formula: | C23 H26 N4 O3 S |
| Smiles: | CCN1CCN(CC1)C(c1ccc2C(N(Cc3ccccc3OC)C(Nc2c1)=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5218 |
| logD: | 2.3455 |
| logSw: | -3.1502 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.133 |
| InChI Key: | LIMGLGYIMVNTLP-UHFFFAOYSA-N |