2-[4-(4-cyclohexylpiperazine-1-carbonyl)anilino]-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Chemical Structure Depiction of
2-[4-(4-cyclohexylpiperazine-1-carbonyl)anilino]-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
2-[4-(4-cyclohexylpiperazine-1-carbonyl)anilino]-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Compound characteristics
| Compound ID: | F127-0478 |
| Compound Name: | 2-[4-(4-cyclohexylpiperazine-1-carbonyl)anilino]-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one |
| Molecular Weight: | 488.61 |
| Molecular Formula: | C26 H28 N6 O2 S |
| Smiles: | C1CCC(CC1)N1CCN(CC1)C(c1ccc(cc1)NC1=NN2C(=Nc3ccccc3C2=O)S1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4438 |
| logD: | 3.0802 |
| logSw: | -3.9404 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.608 |
| InChI Key: | STNRVCXVWIAZCP-UHFFFAOYSA-N |