1-{4-[(3,5-dimethyl-1,2-oxazole-4-sulfonyl)amino]phenyl}-N-[3-(2-oxopyrrolidin-1-yl)propyl]cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
1-{4-[(3,5-dimethyl-1,2-oxazole-4-sulfonyl)amino]phenyl}-N-[3-(2-oxopyrrolidin-1-yl)propyl]cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
1-{4-[(3,5-dimethyl-1,2-oxazole-4-sulfonyl)amino]phenyl}-N-[3-(2-oxopyrrolidin-1-yl)propyl]cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L164-0088 |
| Compound Name: | 1-{4-[(3,5-dimethyl-1,2-oxazole-4-sulfonyl)amino]phenyl}-N-[3-(2-oxopyrrolidin-1-yl)propyl]cyclopropane-1-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 574.58 |
| Molecular Formula: | C22 H28 N4 O5 S |
| Salt: | CF3COOH |
| Smiles: | Cc1c(c(C)on1)S(Nc1ccc(cc1)C1(CC1)C(NCCCN1CCCC1=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5808 |
| logD: | 0.5774 |
| logSw: | -2.2829 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.945 |
| InChI Key: | ZOBMFMRQYKEJCO-UHFFFAOYSA-N |