7-methyl-2-[(prop-2-en-1-yl)amino]-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Chemical Structure Depiction of
7-methyl-2-[(prop-2-en-1-yl)amino]-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
7-methyl-2-[(prop-2-en-1-yl)amino]-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Compound characteristics
| Compound ID: | F127-0163 |
| Compound Name: | 7-methyl-2-[(prop-2-en-1-yl)amino]-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one |
| Molecular Weight: | 272.33 |
| Molecular Formula: | C13 H12 N4 O S |
| Smiles: | Cc1ccc2c(c1)C(N1C(=N2)SC(NCC=C)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1076 |
| logD: | 2.0839 |
| logSw: | -3.0189 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.302 |
| InChI Key: | PKOBRDSOZNNXTB-UHFFFAOYSA-N |