N-butyl-4-{[N-(3-methylbutyl)-N-(propane-1-sulfonyl)glycyl][(2-methylphenyl)methyl]amino}piperidine-1-carboxamide
Chemical Structure Depiction of
N-butyl-4-{[N-(3-methylbutyl)-N-(propane-1-sulfonyl)glycyl][(2-methylphenyl)methyl]amino}piperidine-1-carboxamide
N-butyl-4-{[N-(3-methylbutyl)-N-(propane-1-sulfonyl)glycyl][(2-methylphenyl)methyl]amino}piperidine-1-carboxamide
Compound characteristics
| Compound ID: | V029-3184 |
| Compound Name: | N-butyl-4-{[N-(3-methylbutyl)-N-(propane-1-sulfonyl)glycyl][(2-methylphenyl)methyl]amino}piperidine-1-carboxamide |
| Molecular Weight: | 536.78 |
| Molecular Formula: | C28 H48 N4 O4 S |
| Smiles: | CCCCNC(N1CCC(CC1)N(Cc1ccccc1C)C(CN(CCC(C)C)S(CCC)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.569 |
| logD: | 5.569 |
| logSw: | -5.2578 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.398 |
| InChI Key: | WWHFWJZSEBHTJO-UHFFFAOYSA-N |