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)-N-(2-phenylethyl)acetamide
Chemical Structure Depiction of
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)-N-(2-phenylethyl)acetamide
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)-N-(2-phenylethyl)acetamide
Compound characteristics
| Compound ID: | K284-5068 |
| Compound Name: | 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)-N-(2-phenylethyl)acetamide |
| Molecular Weight: | 491.61 |
| Molecular Formula: | C27 H29 N3 O4 S |
| Smiles: | C1CCC(CCN2C(=Nc3cc4c(cc3C2=O)OCO4)SCC(NCCc2ccccc2)=O)=CC1 |
| Stereo: | ACHIRAL |
| logP: | 4.5442 |
| logD: | 4.5442 |
| logSw: | -4.3372 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.37 |
| InChI Key: | LFPCBFHBJYNNBX-UHFFFAOYSA-N |