7-chloro-3-(pyrrolidine-1-carbonyl)-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
Chemical Structure Depiction of
7-chloro-3-(pyrrolidine-1-carbonyl)-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
7-chloro-3-(pyrrolidine-1-carbonyl)-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
Compound characteristics
| Compound ID: | F083-0032 |
| Compound Name: | 7-chloro-3-(pyrrolidine-1-carbonyl)-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one |
| Molecular Weight: | 365.86 |
| Molecular Formula: | C15 H12 Cl N3 O2 S2 |
| Smiles: | C1CCN(C1)C(C1=C2NC(c3cc(ccc3N2C(=S)S1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6561 |
| logD: | 2.6558 |
| logSw: | -3.6919 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.99 |
| InChI Key: | SQMRDQWXUMHGPZ-UHFFFAOYSA-N |