1-{4-[(3-methylbenzene-1-sulfonyl)amino]phenyl}-N-(propan-2-yl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
1-{4-[(3-methylbenzene-1-sulfonyl)amino]phenyl}-N-(propan-2-yl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
1-{4-[(3-methylbenzene-1-sulfonyl)amino]phenyl}-N-(propan-2-yl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L164-0126 |
| Compound Name: | 1-{4-[(3-methylbenzene-1-sulfonyl)amino]phenyl}-N-(propan-2-yl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 486.51 |
| Molecular Formula: | C20 H24 N2 O3 S |
| Salt: | CF3COOH |
| Smiles: | CC(C)NC(C1(CC1)c1ccc(cc1)NS(c1cccc(C)c1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3985 |
| logD: | 3.3863 |
| logSw: | -3.7742 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.799 |
| InChI Key: | GDIHVTXTUDDNKC-UHFFFAOYSA-N |