1-[4-(4-chlorophenyl)piperazin-1-yl]-6-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]hexan-1-one
Chemical Structure Depiction of
1-[4-(4-chlorophenyl)piperazin-1-yl]-6-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]hexan-1-one
1-[4-(4-chlorophenyl)piperazin-1-yl]-6-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]hexan-1-one
Compound characteristics
| Compound ID: | K297-1062 |
| Compound Name: | 1-[4-(4-chlorophenyl)piperazin-1-yl]-6-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]hexan-1-one |
| Molecular Weight: | 470.04 |
| Molecular Formula: | C24 H28 Cl N5 O S |
| Smiles: | C(CCC(N1CCN(CC1)c1ccc(cc1)[Cl])=O)CCNC1c2ccccc2NC(N=1)=S |
| Stereo: | ACHIRAL |
| logP: | 3.9068 |
| logD: | 2.809 |
| logSw: | -4.514 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.556 |
| InChI Key: | FXZBJRMVDVSDDX-UHFFFAOYSA-N |