ethyl 4-{5-oxo-3-[(propan-2-yl)carbamoyl]-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-8-carbonyl}piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{5-oxo-3-[(propan-2-yl)carbamoyl]-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-8-carbonyl}piperazine-1-carboxylate
ethyl 4-{5-oxo-3-[(propan-2-yl)carbamoyl]-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-8-carbonyl}piperazine-1-carboxylate
Compound characteristics
| Compound ID: | K233-0904 |
| Compound Name: | ethyl 4-{5-oxo-3-[(propan-2-yl)carbamoyl]-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-8-carbonyl}piperazine-1-carboxylate |
| Molecular Weight: | 503.6 |
| Molecular Formula: | C22 H25 N5 O5 S2 |
| Smiles: | CCOC(N1CCN(CC1)C(c1ccc2C(NC3=C(C(NC(C)C)=O)SC(N3c2c1)=S)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4215 |
| logD: | 1.4215 |
| logSw: | -2.7105 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.064 |
| InChI Key: | IDOOSYSKTVZLGI-UHFFFAOYSA-N |