4-[(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]-N-{3-[(propan-2-yl)oxy]propyl}cyclohexane-1-carboxamide
Chemical Structure Depiction of
4-[(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]-N-{3-[(propan-2-yl)oxy]propyl}cyclohexane-1-carboxamide
4-[(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]-N-{3-[(propan-2-yl)oxy]propyl}cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | K284-7577 |
| Compound Name: | 4-[(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]-N-{3-[(propan-2-yl)oxy]propyl}cyclohexane-1-carboxamide |
| Molecular Weight: | 417.57 |
| Molecular Formula: | C22 H31 N3 O3 S |
| Smiles: | CC(C)OCCCNC(C1CCC(CC1)CN1C(c2ccccc2NC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6206 |
| logD: | 3.6195 |
| logSw: | -3.872 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.237 |
| InChI Key: | IDDQBPGGJCAVRJ-UHFFFAOYSA-N |