4-(4-{[N-(4-chlorobenzoyl)-N-(prop-2-en-1-yl)glycyl]amino}phenyl)-N-(3-methylphenyl)piperazine-1-carboxamide
Chemical Structure Depiction of
4-(4-{[N-(4-chlorobenzoyl)-N-(prop-2-en-1-yl)glycyl]amino}phenyl)-N-(3-methylphenyl)piperazine-1-carboxamide
4-(4-{[N-(4-chlorobenzoyl)-N-(prop-2-en-1-yl)glycyl]amino}phenyl)-N-(3-methylphenyl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V005-0592 |
| Compound Name: | 4-(4-{[N-(4-chlorobenzoyl)-N-(prop-2-en-1-yl)glycyl]amino}phenyl)-N-(3-methylphenyl)piperazine-1-carboxamide |
| Molecular Weight: | 546.07 |
| Molecular Formula: | C30 H32 Cl N5 O3 |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)NC(N1CCN(CC1)c1ccc(cc1)NC(CN(CC=C)C(c1ccc(cc1)[Cl])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9588 |
| logD: | 4.9526 |
| logSw: | -5.1106 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.307 |
| InChI Key: | LGPAKCBYTJVVPD-UHFFFAOYSA-N |