2-(2-methoxyanilino)-8-(pyrrolidine-1-carbonyl)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Chemical Structure Depiction of
2-(2-methoxyanilino)-8-(pyrrolidine-1-carbonyl)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
2-(2-methoxyanilino)-8-(pyrrolidine-1-carbonyl)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Compound characteristics
| Compound ID: | E796-0214 |
| Compound Name: | 2-(2-methoxyanilino)-8-(pyrrolidine-1-carbonyl)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one |
| Molecular Weight: | 421.48 |
| Molecular Formula: | C21 H19 N5 O3 S |
| Smiles: | COc1ccccc1NC1=NN2C(=Nc3cc(ccc3C2=O)C(N2CCCC2)=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 2.7778 |
| logD: | 2.6816 |
| logSw: | -3.5344 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.814 |
| InChI Key: | LMEOPWZMUWQTLW-UHFFFAOYSA-N |