N-(5-chloro-2-methoxyphenyl)-2-{4-[(7-methyl-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazin-1-yl}acetamide
Chemical Structure Depiction of
N-(5-chloro-2-methoxyphenyl)-2-{4-[(7-methyl-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazin-1-yl}acetamide
N-(5-chloro-2-methoxyphenyl)-2-{4-[(7-methyl-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazin-1-yl}acetamide
Compound characteristics
Compound ID: | J079-1007 |
Compound Name: | N-(5-chloro-2-methoxyphenyl)-2-{4-[(7-methyl-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazin-1-yl}acetamide |
Molecular Weight: | 455.94 |
Molecular Formula: | C24 H26 Cl N3 O4 |
Smiles: | Cc1ccc2C(CN3CCN(CC3)CC(Nc3cc(ccc3OC)[Cl])=O)=CC(=O)Oc2c1 |
Stereo: | ACHIRAL |
logP: | 3.449 |
logD: | 3.4306 |
logSw: | -3.865 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.001 |
InChI Key: | PDLYDKBKYCDTOW-UHFFFAOYSA-N |