methyl 3-(2H-1,3-benzodioxol-5-yl)-4-oxo-2-(1,3-thiazolidin-3-yl)-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 3-(2H-1,3-benzodioxol-5-yl)-4-oxo-2-(1,3-thiazolidin-3-yl)-3,4-dihydroquinazoline-7-carboxylate
methyl 3-(2H-1,3-benzodioxol-5-yl)-4-oxo-2-(1,3-thiazolidin-3-yl)-3,4-dihydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | M124-0664 |
| Compound Name: | methyl 3-(2H-1,3-benzodioxol-5-yl)-4-oxo-2-(1,3-thiazolidin-3-yl)-3,4-dihydroquinazoline-7-carboxylate |
| Molecular Weight: | 411.43 |
| Molecular Formula: | C20 H17 N3 O5 S |
| Smiles: | COC(c1ccc2C(N(C(=Nc2c1)N1CCSC1)c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6491 |
| logD: | 2.6491 |
| logSw: | -3.1757 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.854 |
| InChI Key: | ZEAPLXXLQNLDPE-UHFFFAOYSA-N |