2-({3-[(2H-1,3-benzodioxol-5-yl)methyl]-6-(morpholin-4-yl)-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)-N-[4-(dimethylamino)phenyl]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-[4-(dimethylamino)phenyl]acetamide
2-({3-[(2H-1,3-benzodioxol-5-yl)methyl]-6-(morpholin-4-yl)-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)-N-[4-(dimethylamino)phenyl]acetamide
Compound characteristics
| Compound ID: | K284-6902 |
| Compound Name: | 2-({3-[(2H-1,3-benzodioxol-5-yl)methyl]-6-(morpholin-4-yl)-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)-N-[4-(dimethylamino)phenyl]acetamide |
| Molecular Weight: | 573.67 |
| Molecular Formula: | C30 H31 N5 O5 S |
| Smiles: | CN(C)c1ccc(cc1)NC(CSC1=Nc2ccc(cc2C(N1Cc1ccc2c(c1)OCO2)=O)N1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9831 |
| logD: | 3.9746 |
| logSw: | -4.0613 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.202 |
| InChI Key: | GOQLHJIFFQAMKE-UHFFFAOYSA-N |