2,2-dimethyl-N-(3-methylphenyl)-3,4-dihydro-2H-1-benzopyran-6-sulfonamide
Chemical Structure Depiction of
2,2-dimethyl-N-(3-methylphenyl)-3,4-dihydro-2H-1-benzopyran-6-sulfonamide
2,2-dimethyl-N-(3-methylphenyl)-3,4-dihydro-2H-1-benzopyran-6-sulfonamide
Compound characteristics
| Compound ID: | D735-0052 |
| Compound Name: | 2,2-dimethyl-N-(3-methylphenyl)-3,4-dihydro-2H-1-benzopyran-6-sulfonamide |
| Molecular Weight: | 331.43 |
| Molecular Formula: | C18 H21 N O3 S |
| Smiles: | Cc1cccc(c1)NS(c1ccc2c(CCC(C)(C)O2)c1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3996 |
| logD: | 4.3985 |
| logSw: | -4.3945 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.221 |
| InChI Key: | DMSDFOCJCXKPEF-UHFFFAOYSA-N |