4-(4-{[N-(3-methylbutanoyl)-N-(propan-2-yl)glycyl]amino}phenyl)-N-(3-methylphenyl)piperazine-1-carboxamide
Chemical Structure Depiction of
4-(4-{[N-(3-methylbutanoyl)-N-(propan-2-yl)glycyl]amino}phenyl)-N-(3-methylphenyl)piperazine-1-carboxamide
4-(4-{[N-(3-methylbutanoyl)-N-(propan-2-yl)glycyl]amino}phenyl)-N-(3-methylphenyl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V005-5947 |
| Compound Name: | 4-(4-{[N-(3-methylbutanoyl)-N-(propan-2-yl)glycyl]amino}phenyl)-N-(3-methylphenyl)piperazine-1-carboxamide |
| Molecular Weight: | 493.65 |
| Molecular Formula: | C28 H39 N5 O3 |
| Salt: | not_available |
| Smiles: | CC(C)CC(N(CC(Nc1ccc(cc1)N1CCN(CC1)C(Nc1cccc(C)c1)=O)=O)C(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6647 |
| logD: | 4.6585 |
| logSw: | -4.3362 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.816 |
| InChI Key: | KHFCHHUTWOVDHO-UHFFFAOYSA-N |