3-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)butanamide
Chemical Structure Depiction of
3-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)butanamide
3-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)butanamide
Compound characteristics
| Compound ID: | E667-1357 |
| Compound Name: | 3-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)butanamide |
| Molecular Weight: | 442.53 |
| Molecular Formula: | C23 H26 N2 O5 S |
| Smiles: | CC(CC(NC1CCCc2ccccc12)=O)S(c1cc2c(cc1C)NC(CO2)=O)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.7602 |
| logD: | 2.76 |
| logSw: | -3.2696 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.325 |
| InChI Key: | AKDZSVCQTQRFEB-UHFFFAOYSA-N |