N-[3-({(3-chlorobenzene-1-sulfonyl)[(oxolan-2-yl)methyl]amino}methyl)-4-(dimethylamino)phenyl]-3-methylbutanamide
Chemical Structure Depiction of
N-[3-({(3-chlorobenzene-1-sulfonyl)[(oxolan-2-yl)methyl]amino}methyl)-4-(dimethylamino)phenyl]-3-methylbutanamide
N-[3-({(3-chlorobenzene-1-sulfonyl)[(oxolan-2-yl)methyl]amino}methyl)-4-(dimethylamino)phenyl]-3-methylbutanamide
Compound characteristics
| Compound ID: | V013-1024 |
| Compound Name: | N-[3-({(3-chlorobenzene-1-sulfonyl)[(oxolan-2-yl)methyl]amino}methyl)-4-(dimethylamino)phenyl]-3-methylbutanamide |
| Molecular Weight: | 508.08 |
| Molecular Formula: | C25 H34 Cl N3 O4 S |
| Salt: | not_available |
| Smiles: | CC(C)CC(Nc1ccc(c(CN(CC2CCCO2)S(c2cccc(c2)[Cl])(=O)=O)c1)N(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.779 |
| logD: | 4.7775 |
| logSw: | -4.7592 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.65 |
| InChI Key: | DBJJVQDTGPHSAW-JOCHJYFZSA-N |