N-butyl-1-{4-[(3,4-dimethoxybenzene-1-sulfonyl)amino]phenyl}cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-butyl-1-{4-[(3,4-dimethoxybenzene-1-sulfonyl)amino]phenyl}cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
N-butyl-1-{4-[(3,4-dimethoxybenzene-1-sulfonyl)amino]phenyl}cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L164-0822 |
| Compound Name: | N-butyl-1-{4-[(3,4-dimethoxybenzene-1-sulfonyl)amino]phenyl}cyclopropane-1-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 546.56 |
| Molecular Formula: | C22 H28 N2 O5 S |
| Salt: | CF3COOH |
| Smiles: | CCCCNC(C1(CC1)c1ccc(cc1)NS(c1ccc(c(c1)OC)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.212 |
| logD: | 3.2117 |
| logSw: | -3.5289 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.927 |
| InChI Key: | KZHJJFMRICRSIS-UHFFFAOYSA-N |