N-[(4-fluorophenyl)methyl]-N-(2-{4-[4-(3-methylbutanoyl)piperazin-1-yl]anilino}-2-oxoethyl)cyclopentanecarboxamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-N-(2-{4-[4-(3-methylbutanoyl)piperazin-1-yl]anilino}-2-oxoethyl)cyclopentanecarboxamide
N-[(4-fluorophenyl)methyl]-N-(2-{4-[4-(3-methylbutanoyl)piperazin-1-yl]anilino}-2-oxoethyl)cyclopentanecarboxamide
Compound characteristics
| Compound ID: | V005-5994 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-N-(2-{4-[4-(3-methylbutanoyl)piperazin-1-yl]anilino}-2-oxoethyl)cyclopentanecarboxamide |
| Molecular Weight: | 522.66 |
| Molecular Formula: | C30 H39 F N4 O3 |
| Salt: | not_available |
| Smiles: | CC(C)CC(N1CCN(CC1)c1ccc(cc1)NC(CN(Cc1ccc(cc1)F)C(C1CCCC1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6653 |
| logD: | 4.6649 |
| logSw: | -4.2005 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.538 |
| InChI Key: | WTKRQABGQLYPFC-UHFFFAOYSA-N |