N-[(4-methylphenyl)methyl]-N-[3-(2-{[3-(morpholin-4-yl)propyl]amino}-2-oxoethyl)phenyl]-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-N-[3-(2-{[3-(morpholin-4-yl)propyl]amino}-2-oxoethyl)phenyl]-2H-1,3-benzodioxole-5-carboxamide
N-[(4-methylphenyl)methyl]-N-[3-(2-{[3-(morpholin-4-yl)propyl]amino}-2-oxoethyl)phenyl]-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V024-1616 |
| Compound Name: | N-[(4-methylphenyl)methyl]-N-[3-(2-{[3-(morpholin-4-yl)propyl]amino}-2-oxoethyl)phenyl]-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 529.64 |
| Molecular Formula: | C31 H35 N3 O5 |
| Salt: | not_available |
| Smiles: | Cc1ccc(CN(C(c2ccc3c(c2)OCO3)=O)c2cccc(CC(NCCCN3CCOCC3)=O)c2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4378 |
| logD: | 3.0143 |
| logSw: | -3.5123 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.637 |
| InChI Key: | MTJHYVPPTRKTKP-UHFFFAOYSA-N |