1-{4-[(3-methoxybenzene-1-sulfonyl)amino]phenyl}-N-(3-methoxypropyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
1-{4-[(3-methoxybenzene-1-sulfonyl)amino]phenyl}-N-(3-methoxypropyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
1-{4-[(3-methoxybenzene-1-sulfonyl)amino]phenyl}-N-(3-methoxypropyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L164-0541 |
| Compound Name: | 1-{4-[(3-methoxybenzene-1-sulfonyl)amino]phenyl}-N-(3-methoxypropyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 532.53 |
| Molecular Formula: | C21 H26 N2 O5 S |
| Salt: | CF3COOH |
| Smiles: | COCCCNC(C1(CC1)c1ccc(cc1)NS(c1cccc(c1)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4652 |
| logD: | 2.4614 |
| logSw: | -2.9635 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.552 |
| InChI Key: | LRHZPDRKKCZWIN-UHFFFAOYSA-N |