2-({3-[(2H-1,3-benzodioxol-5-yl)methyl]-6-(morpholin-4-yl)-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)-N-ethyl-N-(3-methylphenyl)acetamide
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-ethyl-N-(3-methylphenyl)acetamide
2-({3-[(2H-1,3-benzodioxol-5-yl)methyl]-6-(morpholin-4-yl)-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)-N-ethyl-N-(3-methylphenyl)acetamide
Compound characteristics
| Compound ID: | K284-6916 |
| Compound Name: | 2-({3-[(2H-1,3-benzodioxol-5-yl)methyl]-6-(morpholin-4-yl)-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)-N-ethyl-N-(3-methylphenyl)acetamide |
| Molecular Weight: | 572.68 |
| Molecular Formula: | C31 H32 N4 O5 S |
| Smiles: | CCN(C(CSC1=Nc2ccc(cc2C(N1Cc1ccc2c(c1)OCO2)=O)N1CCOCC1)=O)c1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.8226 |
| logD: | 4.8226 |
| logSw: | -4.574 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.339 |
| InChI Key: | XHTUYXRNESJDDK-UHFFFAOYSA-N |