ethyl 4-[(8-chloro-5-oxo-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carbonyl)amino]benzoate
Chemical Structure Depiction of
ethyl 4-[(8-chloro-5-oxo-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carbonyl)amino]benzoate
ethyl 4-[(8-chloro-5-oxo-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | F083-0069 |
| Compound Name: | ethyl 4-[(8-chloro-5-oxo-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carbonyl)amino]benzoate |
| Molecular Weight: | 459.93 |
| Molecular Formula: | C20 H14 Cl N3 O4 S2 |
| Smiles: | CCOC(c1ccc(cc1)NC(C1=C2NC(c3ccc(cc3N2C(=S)S1)[Cl])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2138 |
| logD: | 4.2138 |
| logSw: | -4.4937 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.821 |
| InChI Key: | YLWXYYOUPQOOMY-UHFFFAOYSA-N |