N-cycloheptyl-3-[2-(diethylamino)ethyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-cycloheptyl-3-[2-(diethylamino)ethyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
N-cycloheptyl-3-[2-(diethylamino)ethyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | K288-0431 |
| Compound Name: | N-cycloheptyl-3-[2-(diethylamino)ethyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 416.58 |
| Molecular Formula: | C22 H32 N4 O2 S |
| Smiles: | CCN(CC)CCN1C(c2ccc(cc2NC1=S)C(NC1CCCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0181 |
| logD: | 2.5706 |
| logSw: | -4.062 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.449 |
| InChI Key: | UJWRJRACOHNGAE-UHFFFAOYSA-N |