N-[2-(4-ethylpiperazin-1-yl)ethyl]-4-[(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexane-1-carboxamide
Chemical Structure Depiction of
N-[2-(4-ethylpiperazin-1-yl)ethyl]-4-[(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexane-1-carboxamide
N-[2-(4-ethylpiperazin-1-yl)ethyl]-4-[(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | K284-7612 |
| Compound Name: | N-[2-(4-ethylpiperazin-1-yl)ethyl]-4-[(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexane-1-carboxamide |
| Molecular Weight: | 457.64 |
| Molecular Formula: | C24 H35 N5 O2 S |
| Smiles: | CCN1CCN(CCNC(C2CCC(CC2)CN2C(c3ccccc3NC2=S)=O)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 2.7847 |
| logD: | 1.9922 |
| logSw: | -3.5376 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.284 |
| InChI Key: | IFWKFEUEDMRJNL-UHFFFAOYSA-N |