1-[3-(azepane-1-carbonyl)phenyl]-3-[(4-chlorophenyl)methyl]-1,3-diazinan-2-one
Chemical Structure Depiction of
1-[3-(azepane-1-carbonyl)phenyl]-3-[(4-chlorophenyl)methyl]-1,3-diazinan-2-one
1-[3-(azepane-1-carbonyl)phenyl]-3-[(4-chlorophenyl)methyl]-1,3-diazinan-2-one
Compound characteristics
| Compound ID: | J077-1273 |
| Compound Name: | 1-[3-(azepane-1-carbonyl)phenyl]-3-[(4-chlorophenyl)methyl]-1,3-diazinan-2-one |
| Molecular Weight: | 425.96 |
| Molecular Formula: | C24 H28 Cl N3 O2 |
| Smiles: | C1CCCN(CC1)C(c1cccc(c1)N1CCCN(Cc2ccc(cc2)[Cl])C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4247 |
| logD: | 4.4247 |
| logSw: | -4.6099 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 36.776 |
| InChI Key: | FCNLRZUAFOSEQC-UHFFFAOYSA-N |