N-({1-[1-(4-chlorobenzene-1-sulfonyl)cyclopropane-1-carbonyl]piperidin-3-yl}methyl)but-2-ynamide
Chemical Structure Depiction of
N-({1-[1-(4-chlorobenzene-1-sulfonyl)cyclopropane-1-carbonyl]piperidin-3-yl}methyl)but-2-ynamide
N-({1-[1-(4-chlorobenzene-1-sulfonyl)cyclopropane-1-carbonyl]piperidin-3-yl}methyl)but-2-ynamide
Compound characteristics
| Compound ID: | T002-5441 |
| Compound Name: | N-({1-[1-(4-chlorobenzene-1-sulfonyl)cyclopropane-1-carbonyl]piperidin-3-yl}methyl)but-2-ynamide |
| Molecular Weight: | 422.93 |
| Molecular Formula: | C20 H23 Cl N2 O4 S |
| Smiles: | CC#CC(NCC1CCCN(C1)C(C1(CC1)S(c1ccc(cc1)[Cl])(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3419 |
| logD: | 2.3419 |
| logSw: | -3.3406 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.316 |
| InChI Key: | JHVPPBWQZSMLQI-OAHLLOKOSA-N |