N-cyclohexyl-N-{[2-(dimethylamino)-5-(3-methylbutanamido)phenyl]methyl}-4-fluorobenzamide
Chemical Structure Depiction of
N-cyclohexyl-N-{[2-(dimethylamino)-5-(3-methylbutanamido)phenyl]methyl}-4-fluorobenzamide
N-cyclohexyl-N-{[2-(dimethylamino)-5-(3-methylbutanamido)phenyl]methyl}-4-fluorobenzamide
Compound characteristics
| Compound ID: | V025-1707 |
| Compound Name: | N-cyclohexyl-N-{[2-(dimethylamino)-5-(3-methylbutanamido)phenyl]methyl}-4-fluorobenzamide |
| Molecular Weight: | 453.6 |
| Molecular Formula: | C27 H36 F N3 O2 |
| Salt: | not_available |
| Smiles: | CC(C)CC(Nc1ccc(c(CN(C2CCCCC2)C(c2ccc(cc2)F)=O)c1)N(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9393 |
| logD: | 5.9286 |
| logSw: | -5.3854 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.076 |
| InChI Key: | KIEGNKCAAQVMFY-UHFFFAOYSA-N |