3-[4-(azepane-1-sulfonyl)anilino]-2-benzyl-2,3-dihydro-1H-isoindol-1-one
Chemical Structure Depiction of
3-[4-(azepane-1-sulfonyl)anilino]-2-benzyl-2,3-dihydro-1H-isoindol-1-one
3-[4-(azepane-1-sulfonyl)anilino]-2-benzyl-2,3-dihydro-1H-isoindol-1-one
Compound characteristics
| Compound ID: | C612-0353 |
| Compound Name: | 3-[4-(azepane-1-sulfonyl)anilino]-2-benzyl-2,3-dihydro-1H-isoindol-1-one |
| Molecular Weight: | 475.61 |
| Molecular Formula: | C27 H29 N3 O3 S |
| Smiles: | C1CCCN(CC1)S(c1ccc(cc1)NC1c2ccccc2C(N1Cc1ccccc1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8243 |
| logD: | 4.8243 |
| logSw: | -4.6648 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.044 |
| InChI Key: | RNAHWAASKADECT-SANMLTNESA-N |