N-(4-fluorophenyl)-2-({7-[(4-methoxyphenyl)methyl]-8-oxo-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-6-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-2-({7-[(4-methoxyphenyl)methyl]-8-oxo-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-6-yl}sulfanyl)acetamide
N-(4-fluorophenyl)-2-({7-[(4-methoxyphenyl)methyl]-8-oxo-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-6-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | K284-6169 |
| Compound Name: | N-(4-fluorophenyl)-2-({7-[(4-methoxyphenyl)methyl]-8-oxo-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-6-yl}sulfanyl)acetamide |
| Molecular Weight: | 493.51 |
| Molecular Formula: | C25 H20 F N3 O5 S |
| Smiles: | COc1ccc(CN2C(=Nc3cc4c(cc3C2=O)OCO4)SCC(Nc2ccc(cc2)F)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.7445 |
| logD: | 4.7444 |
| logSw: | -4.5103 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.58 |
| InChI Key: | XTGOHFBQRONCCR-UHFFFAOYSA-N |