2-butyl-N-[(4-chlorophenyl)methyl]-3-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Chemical Structure Depiction of
2-butyl-N-[(4-chlorophenyl)methyl]-3-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
2-butyl-N-[(4-chlorophenyl)methyl]-3-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Compound characteristics
| Compound ID: | L678-0258 |
| Compound Name: | 2-butyl-N-[(4-chlorophenyl)methyl]-3-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxamide |
| Molecular Weight: | 384.9 |
| Molecular Formula: | C22 H25 Cl N2 O2 |
| Smiles: | CCCCN1C(c2ccccc2CC1(C)C(NCc1ccc(cc1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.859 |
| logD: | 4.8589 |
| logSw: | -4.8101 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.596 |
| InChI Key: | LQGJGQHHKOZMET-QFIPXVFZSA-N |