1-{4-[(3-chloro-4-fluorobenzene-1-sulfonyl)amino]phenyl}-N-(3-methoxypropyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
1-{4-[(3-chloro-4-fluorobenzene-1-sulfonyl)amino]phenyl}-N-(3-methoxypropyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
1-{4-[(3-chloro-4-fluorobenzene-1-sulfonyl)amino]phenyl}-N-(3-methoxypropyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L164-0537 |
| Compound Name: | 1-{4-[(3-chloro-4-fluorobenzene-1-sulfonyl)amino]phenyl}-N-(3-methoxypropyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 554.94 |
| Molecular Formula: | C20 H22 Cl F N2 O4 S |
| Salt: | CF3COOH |
| Smiles: | COCCCNC(C1(CC1)c1ccc(cc1)NS(c1ccc(c(c1)[Cl])F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9816 |
| logD: | 2.9502 |
| logSw: | -3.538 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.008 |
| InChI Key: | SEUZCUQEFRZZND-UHFFFAOYSA-N |