5-(4-chlorobenzamido)-N,N-diethyl-2-[4-(3-methylbutanoyl)-1,4-diazepan-1-yl]benzamide
Chemical Structure Depiction of
5-(4-chlorobenzamido)-N,N-diethyl-2-[4-(3-methylbutanoyl)-1,4-diazepan-1-yl]benzamide
5-(4-chlorobenzamido)-N,N-diethyl-2-[4-(3-methylbutanoyl)-1,4-diazepan-1-yl]benzamide
Compound characteristics
| Compound ID: | V012-9869 |
| Compound Name: | 5-(4-chlorobenzamido)-N,N-diethyl-2-[4-(3-methylbutanoyl)-1,4-diazepan-1-yl]benzamide |
| Molecular Weight: | 513.08 |
| Molecular Formula: | C28 H37 Cl N4 O3 |
| Salt: | not_available |
| Smiles: | CCN(CC)C(c1cc(ccc1N1CCCN(CC1)C(CC(C)C)=O)NC(c1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6454 |
| logD: | 4.6447 |
| logSw: | -4.7061 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.945 |
| InChI Key: | JLSOYQNXVWIMKW-UHFFFAOYSA-N |