N-cyclopropyl-N-[3-oxo-3-(piperazin-1-yl)propyl]-4-(propan-2-yl)benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-cyclopropyl-N-[3-oxo-3-(piperazin-1-yl)propyl]-4-(propan-2-yl)benzene-1-sulfonamide--trifluoroacetic acid (1/1)
N-cyclopropyl-N-[3-oxo-3-(piperazin-1-yl)propyl]-4-(propan-2-yl)benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F482-0408 |
| Compound Name: | N-cyclopropyl-N-[3-oxo-3-(piperazin-1-yl)propyl]-4-(propan-2-yl)benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 493.54 |
| Molecular Formula: | C19 H29 N3 O3 S |
| Salt: | CF3COOH |
| Smiles: | CC(C)c1ccc(cc1)S(N(CCC(N1CCNCC1)=O)C1CC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0608 |
| logD: | 1.2328 |
| logSw: | -2.6819 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.288 |
| InChI Key: | LRMXSHVBEMNBHX-UHFFFAOYSA-N |