ethyl 4-[(7-methyl-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-[(7-methyl-5-oxo-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carbonyl)amino]benzoate
ethyl 4-[(7-methyl-5-oxo-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | F083-0441 |
| Compound Name: | ethyl 4-[(7-methyl-5-oxo-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carbonyl)amino]benzoate |
| Molecular Weight: | 439.51 |
| Molecular Formula: | C21 H17 N3 O4 S2 |
| Smiles: | CCOC(c1ccc(cc1)NC(C1=C2NC(c3cc(C)ccc3N2C(=S)S1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9324 |
| logD: | 3.9324 |
| logSw: | -4.0607 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.821 |
| InChI Key: | NFQVXIXZQGKMCH-UHFFFAOYSA-N |