(2Z)-2-{[4-(difluoromethoxy)-3-methoxyphenyl]methylidene}-5-methyl-N-(2-methylphenyl)-1-oxo-1,2-dihydro-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocine-13-carboxamide
Chemical Structure Depiction of
(2Z)-2-{[4-(difluoromethoxy)-3-methoxyphenyl]methylidene}-5-methyl-N-(2-methylphenyl)-1-oxo-1,2-dihydro-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocine-13-carboxamide
(2Z)-2-{[4-(difluoromethoxy)-3-methoxyphenyl]methylidene}-5-methyl-N-(2-methylphenyl)-1-oxo-1,2-dihydro-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocine-13-carboxamide
Compound characteristics
| Compound ID: | Y502-4661 |
| Compound Name: | (2Z)-2-{[4-(difluoromethoxy)-3-methoxyphenyl]methylidene}-5-methyl-N-(2-methylphenyl)-1-oxo-1,2-dihydro-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocine-13-carboxamide |
| Molecular Weight: | 577.61 |
| Molecular Formula: | C30 H25 F2 N3 O5 S |
| Smiles: | Cc1ccccc1NC(C1C2c3ccccc3OC1(C)N=C1N2C(/C(=C/c2ccc(c(c2)OC)OC(F)F)S1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.723 |
| logD: | 4.7219 |
| logSw: | -4.6743 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.108 |
| InChI Key: | GDMCUPOQUNUUQW-UHFFFAOYSA-N |