N-{[5-(4-chlorobutanamido)-2-(dimethylamino)phenyl]methyl}-3,3-dimethyl-N-[(oxolan-2-yl)methyl]butanamide
Chemical Structure Depiction of
N-{[5-(4-chlorobutanamido)-2-(dimethylamino)phenyl]methyl}-3,3-dimethyl-N-[(oxolan-2-yl)methyl]butanamide
N-{[5-(4-chlorobutanamido)-2-(dimethylamino)phenyl]methyl}-3,3-dimethyl-N-[(oxolan-2-yl)methyl]butanamide
Compound characteristics
| Compound ID: | V029-1114 |
| Compound Name: | N-{[5-(4-chlorobutanamido)-2-(dimethylamino)phenyl]methyl}-3,3-dimethyl-N-[(oxolan-2-yl)methyl]butanamide |
| Molecular Weight: | 452.04 |
| Molecular Formula: | C24 H38 Cl N3 O3 |
| Salt: | not_available |
| Smiles: | CC(C)(C)CC(N(CC1CCCO1)Cc1cc(ccc1N(C)C)NC(CCC[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8325 |
| logD: | 3.8305 |
| logSw: | -4.029 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.23 |
| InChI Key: | LSXCNRKEEUHDIH-HXUWFJFHSA-N |