N-({1-[(3-chlorophenyl)methyl]piperidin-4-yl}methyl)-4-(methanesulfonyl)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanamide
Chemical Structure Depiction of
N-({1-[(3-chlorophenyl)methyl]piperidin-4-yl}methyl)-4-(methanesulfonyl)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanamide
N-({1-[(3-chlorophenyl)methyl]piperidin-4-yl}methyl)-4-(methanesulfonyl)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanamide
Compound characteristics
| Compound ID: | E612-1238 |
| Compound Name: | N-({1-[(3-chlorophenyl)methyl]piperidin-4-yl}methyl)-4-(methanesulfonyl)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanamide |
| Molecular Weight: | 518.07 |
| Molecular Formula: | C26 H32 Cl N3 O4 S |
| Smiles: | CS(CCC(C(NCC1CCN(CC1)Cc1cccc(c1)[Cl])=O)N1Cc2ccccc2C1=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6815 |
| logD: | 0.865 |
| logSw: | -3.7288 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.406 |
| InChI Key: | BZJNVQSZYIHNRP-DEOSSOPVSA-N |