N-[3-(butylsulfanyl)propyl]-4-{[(4-chlorobenzene-1-sulfonyl)amino]methyl}cyclohexane-1-carboxamide
Chemical Structure Depiction of
N-[3-(butylsulfanyl)propyl]-4-{[(4-chlorobenzene-1-sulfonyl)amino]methyl}cyclohexane-1-carboxamide
N-[3-(butylsulfanyl)propyl]-4-{[(4-chlorobenzene-1-sulfonyl)amino]methyl}cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | K788-3514 |
| Compound Name: | N-[3-(butylsulfanyl)propyl]-4-{[(4-chlorobenzene-1-sulfonyl)amino]methyl}cyclohexane-1-carboxamide |
| Molecular Weight: | 461.08 |
| Molecular Formula: | C21 H33 Cl N2 O3 S2 |
| Smiles: | CCCCSCCCNC(C1CCC(CC1)CNS(c1ccc(cc1)[Cl])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0569 |
| logD: | 5.0569 |
| logSw: | -5.0547 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.715 |
| InChI Key: | LEMZWRINSBRJLD-UHFFFAOYSA-N |