[2-chloro-5-(methylsulfanyl)phenyl](4-{4-[(pyrrolidin-1-yl)methyl]-1,3-thiazol-2-yl}piperazin-1-yl)methanone
Chemical Structure Depiction of
[2-chloro-5-(methylsulfanyl)phenyl](4-{4-[(pyrrolidin-1-yl)methyl]-1,3-thiazol-2-yl}piperazin-1-yl)methanone
[2-chloro-5-(methylsulfanyl)phenyl](4-{4-[(pyrrolidin-1-yl)methyl]-1,3-thiazol-2-yl}piperazin-1-yl)methanone
Compound characteristics
| Compound ID: | P055-0021 |
| Compound Name: | [2-chloro-5-(methylsulfanyl)phenyl](4-{4-[(pyrrolidin-1-yl)methyl]-1,3-thiazol-2-yl}piperazin-1-yl)methanone |
| Molecular Weight: | 437.02 |
| Molecular Formula: | C20 H25 Cl N4 O S2 |
| Smiles: | CSc1ccc(c(c1)C(N1CCN(CC1)c1nc(CN2CCCC2)cs1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.1034 |
| logD: | 1.2453 |
| logSw: | -4.4296 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.561 |
| InChI Key: | CMQGLAFNGKPDEF-UHFFFAOYSA-N |