N-ethyl-N'-{4-[4-(3-methylbutanoyl)-1,4-diazepan-1-yl]-3-(piperidine-1-carbonyl)phenyl}urea
Chemical Structure Depiction of
N-ethyl-N'-{4-[4-(3-methylbutanoyl)-1,4-diazepan-1-yl]-3-(piperidine-1-carbonyl)phenyl}urea
N-ethyl-N'-{4-[4-(3-methylbutanoyl)-1,4-diazepan-1-yl]-3-(piperidine-1-carbonyl)phenyl}urea
Compound characteristics
| Compound ID: | V028-2264 |
| Compound Name: | N-ethyl-N'-{4-[4-(3-methylbutanoyl)-1,4-diazepan-1-yl]-3-(piperidine-1-carbonyl)phenyl}urea |
| Molecular Weight: | 457.62 |
| Molecular Formula: | C25 H39 N5 O3 |
| Salt: | not_available |
| Smiles: | CCNC(Nc1ccc(c(c1)C(N1CCCCC1)=O)N1CCCN(CC1)C(CC(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3724 |
| logD: | 3.3721 |
| logSw: | -3.7416 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.092 |
| InChI Key: | VGFCJZPJKONHBC-UHFFFAOYSA-N |