methyl 3-(3-hydroxypropyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 3-(3-hydroxypropyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
methyl 3-(3-hydroxypropyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | F207-0056 |
| Compound Name: | methyl 3-(3-hydroxypropyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate |
| Molecular Weight: | 294.33 |
| Molecular Formula: | C13 H14 N2 O4 S |
| Smiles: | COC(c1ccc2C(N(CCCO)C(Nc2c1)=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4273 |
| logD: | 1.4231 |
| logSw: | -2.4437 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.397 |
| InChI Key: | LTJZNHWIBUYMOD-UHFFFAOYSA-N |