2-({3-[(2H-1,3-benzodioxol-5-yl)methyl]-6-(morpholin-4-yl)-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)-N-benzyl-N-ethylacetamide
Chemical Structure Depiction of
2-({3-[(2H-1,3-benzodioxol-5-yl)methyl]-6-(morpholin-4-yl)-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)-N-benzyl-N-ethylacetamide
2-({3-[(2H-1,3-benzodioxol-5-yl)methyl]-6-(morpholin-4-yl)-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)-N-benzyl-N-ethylacetamide
Compound characteristics
| Compound ID: | K284-6931 |
| Compound Name: | 2-({3-[(2H-1,3-benzodioxol-5-yl)methyl]-6-(morpholin-4-yl)-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)-N-benzyl-N-ethylacetamide |
| Molecular Weight: | 572.68 |
| Molecular Formula: | C31 H32 N4 O5 S |
| Smiles: | CCN(Cc1ccccc1)C(CSC1=Nc2ccc(cc2C(N1Cc1ccc2c(c1)OCO2)=O)N1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1268 |
| logD: | 4.1267 |
| logSw: | -4.0878 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.927 |
| InChI Key: | ZEONODAUFKUQCV-UHFFFAOYSA-N |