3,4-dichloro-N-{4-methyl-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1,3-thiazol-2(3H)-ylidene}benzamide
Chemical Structure Depiction of
3,4-dichloro-N-{4-methyl-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1,3-thiazol-2(3H)-ylidene}benzamide
3,4-dichloro-N-{4-methyl-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1,3-thiazol-2(3H)-ylidene}benzamide
Compound characteristics
Compound ID: | V005-6077 |
Compound Name: | 3,4-dichloro-N-{4-methyl-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1,3-thiazol-2(3H)-ylidene}benzamide |
Molecular Weight: | 398.31 |
Molecular Formula: | C17 H17 Cl2 N3 O2 S |
Smiles: | CC1=CSC(=N/C(c2ccc(c(c2)[Cl])[Cl])=O)\N1CC(N1CCCC1)=O |
Stereo: | ACHIRAL |
logP: | 3.3547 |
logD: | 3.3547 |
logSw: | -3.6978 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 42.103 |
InChI Key: | SWZDQLDMQUXWFD-JZJYNLBNSA-N |