3-[4-(azepane-1-sulfonyl)anilino]-2-[(furan-2-yl)methyl]-2,3-dihydro-1H-isoindol-1-one
Chemical Structure Depiction of
3-[4-(azepane-1-sulfonyl)anilino]-2-[(furan-2-yl)methyl]-2,3-dihydro-1H-isoindol-1-one
3-[4-(azepane-1-sulfonyl)anilino]-2-[(furan-2-yl)methyl]-2,3-dihydro-1H-isoindol-1-one
Compound characteristics
| Compound ID: | C429-0142 |
| Compound Name: | 3-[4-(azepane-1-sulfonyl)anilino]-2-[(furan-2-yl)methyl]-2,3-dihydro-1H-isoindol-1-one |
| Molecular Weight: | 465.57 |
| Molecular Formula: | C25 H27 N3 O4 S |
| Smiles: | C1CCCN(CC1)S(c1ccc(cc1)NC1c2ccccc2C(N1Cc1ccco1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3933 |
| logD: | 4.3933 |
| logSw: | -4.2323 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.793 |
| InChI Key: | MNIVYINOFYUQJA-DEOSSOPVSA-N |