4-chloro-N-{4-[4-(3-methylbutanoyl)piperazin-1-yl]-3-(morpholine-4-carbonyl)phenyl}benzamide
Chemical Structure Depiction of
4-chloro-N-{4-[4-(3-methylbutanoyl)piperazin-1-yl]-3-(morpholine-4-carbonyl)phenyl}benzamide
4-chloro-N-{4-[4-(3-methylbutanoyl)piperazin-1-yl]-3-(morpholine-4-carbonyl)phenyl}benzamide
Compound characteristics
| Compound ID: | V014-2701 |
| Compound Name: | 4-chloro-N-{4-[4-(3-methylbutanoyl)piperazin-1-yl]-3-(morpholine-4-carbonyl)phenyl}benzamide |
| Molecular Weight: | 513.04 |
| Molecular Formula: | C27 H33 Cl N4 O4 |
| Salt: | not_available |
| Smiles: | CC(C)CC(N1CCN(CC1)c1ccc(cc1C(N1CCOCC1)=O)NC(c1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5678 |
| logD: | 3.5674 |
| logSw: | -4.088 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.238 |
| InChI Key: | JFYCRNTXUPJLQD-UHFFFAOYSA-N |