N-benzyl-2-({7-[2-(cyclohex-1-en-1-yl)ethyl]-8-oxo-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-6-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-benzyl-2-({7-[2-(cyclohex-1-en-1-yl)ethyl]-8-oxo-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-6-yl}sulfanyl)acetamide
N-benzyl-2-({7-[2-(cyclohex-1-en-1-yl)ethyl]-8-oxo-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-6-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | K284-5067 |
| Compound Name: | N-benzyl-2-({7-[2-(cyclohex-1-en-1-yl)ethyl]-8-oxo-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-6-yl}sulfanyl)acetamide |
| Molecular Weight: | 477.58 |
| Molecular Formula: | C26 H27 N3 O4 S |
| Smiles: | C1CCC(CCN2C(=Nc3cc4c(cc3C2=O)OCO4)SCC(NCc2ccccc2)=O)=CC1 |
| Stereo: | ACHIRAL |
| logP: | 4.7695 |
| logD: | 4.7695 |
| logSw: | -4.6435 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.529 |
| InChI Key: | DUELXKRDGALVEJ-UHFFFAOYSA-N |