7-methyl-3-(pyrrolidine-1-carbonyl)-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
Chemical Structure Depiction of
7-methyl-3-(pyrrolidine-1-carbonyl)-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
7-methyl-3-(pyrrolidine-1-carbonyl)-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
Compound characteristics
| Compound ID: | F083-0466 |
| Compound Name: | 7-methyl-3-(pyrrolidine-1-carbonyl)-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one |
| Molecular Weight: | 345.44 |
| Molecular Formula: | C16 H15 N3 O2 S2 |
| Smiles: | Cc1ccc2c(c1)C(NC1=C(C(N3CCCC3)=O)SC(N12)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3817 |
| logD: | 2.3816 |
| logSw: | -3.1046 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.99 |
| InChI Key: | XGCQWFMPTPFTGA-UHFFFAOYSA-N |