4-[6-{[(4-tert-butylphenyl)methyl]sulfanyl}-8-oxo-2H-[1,3]dioxolo[4,5-g]quinazolin-7(8H)-yl]-N-[(4-methoxyphenyl)methyl]butanamide
Chemical Structure Depiction of
4-[6-{[(4-tert-butylphenyl)methyl]sulfanyl}-8-oxo-2H-[1,3]dioxolo[4,5-g]quinazolin-7(8H)-yl]-N-[(4-methoxyphenyl)methyl]butanamide
4-[6-{[(4-tert-butylphenyl)methyl]sulfanyl}-8-oxo-2H-[1,3]dioxolo[4,5-g]quinazolin-7(8H)-yl]-N-[(4-methoxyphenyl)methyl]butanamide
Compound characteristics
| Compound ID: | K284-5591 |
| Compound Name: | 4-[6-{[(4-tert-butylphenyl)methyl]sulfanyl}-8-oxo-2H-[1,3]dioxolo[4,5-g]quinazolin-7(8H)-yl]-N-[(4-methoxyphenyl)methyl]butanamide |
| Molecular Weight: | 573.71 |
| Molecular Formula: | C32 H35 N3 O5 S |
| Smiles: | CC(C)(C)c1ccc(CSC2=Nc3cc4c(cc3C(N2CCCC(NCc2ccc(cc2)OC)=O)=O)OCO4)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.7238 |
| logD: | 5.7238 |
| logSw: | -5.2934 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.88 |
| InChI Key: | GTIMQFXLAFWWSK-UHFFFAOYSA-N |