N-(3-methylbutyl)-3-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)propanamide
Chemical Structure Depiction of
N-(3-methylbutyl)-3-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)propanamide
N-(3-methylbutyl)-3-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)propanamide
Compound characteristics
| Compound ID: | E975-1142 |
| Compound Name: | N-(3-methylbutyl)-3-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)propanamide |
| Molecular Weight: | 354.42 |
| Molecular Formula: | C16 H22 N2 O5 S |
| Smiles: | CC(C)CCNC(CCS(c1ccc2c(c1)OC(N2C)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0984 |
| logD: | 1.0984 |
| logSw: | -2.4428 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.453 |
| InChI Key: | BRUURYJAAUUULG-UHFFFAOYSA-N |