2-chloro-N-{3-[cyclohexyl(methyl)amino]propyl}-5-(thiomorpholine-4-sulfonyl)benzamide
Chemical Structure Depiction of
2-chloro-N-{3-[cyclohexyl(methyl)amino]propyl}-5-(thiomorpholine-4-sulfonyl)benzamide
2-chloro-N-{3-[cyclohexyl(methyl)amino]propyl}-5-(thiomorpholine-4-sulfonyl)benzamide
Compound characteristics
Compound ID: | L586-1480 |
Compound Name: | 2-chloro-N-{3-[cyclohexyl(methyl)amino]propyl}-5-(thiomorpholine-4-sulfonyl)benzamide |
Molecular Weight: | 474.08 |
Molecular Formula: | C21 H32 Cl N3 O3 S2 |
Smiles: | CN(CCCNC(c1cc(ccc1[Cl])S(N1CCSCC1)(=O)=O)=O)C1CCCCC1 |
Stereo: | ACHIRAL |
logP: | 3.5039 |
logD: | 0.9792 |
logSw: | -3.9601 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 59.242 |
InChI Key: | BHPYPWUWKORGDR-UHFFFAOYSA-N |