N-[2-(cyclohex-1-en-1-yl)ethyl]-3-[(5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)amino]benzamide
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-3-[(5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)amino]benzamide
N-[2-(cyclohex-1-en-1-yl)ethyl]-3-[(5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)amino]benzamide
Compound characteristics
| Compound ID: | F127-0505 |
| Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-3-[(5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)amino]benzamide |
| Molecular Weight: | 445.54 |
| Molecular Formula: | C24 H23 N5 O2 S |
| Smiles: | C1CCC(CCNC(c2cccc(c2)NC2=NN3C(=Nc4ccccc4C3=O)S2)=O)=CC1 |
| Stereo: | ACHIRAL |
| logP: | 3.9764 |
| logD: | 3.9676 |
| logSw: | -4.259 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.314 |
| InChI Key: | NNYREUMVQYDXDX-UHFFFAOYSA-N |