4,4-dimethyl-6-oxo-2-{[3-(2-oxopyrrolidin-1-yl)propyl]amino}-N-phenylcyclohex-1-ene-1-carbothioamide
Chemical Structure Depiction of
4,4-dimethyl-6-oxo-2-{[3-(2-oxopyrrolidin-1-yl)propyl]amino}-N-phenylcyclohex-1-ene-1-carbothioamide
4,4-dimethyl-6-oxo-2-{[3-(2-oxopyrrolidin-1-yl)propyl]amino}-N-phenylcyclohex-1-ene-1-carbothioamide
Compound characteristics
| Compound ID: | 8017-1970 |
| Compound Name: | 4,4-dimethyl-6-oxo-2-{[3-(2-oxopyrrolidin-1-yl)propyl]amino}-N-phenylcyclohex-1-ene-1-carbothioamide |
| Molecular Weight: | 399.55 |
| Molecular Formula: | C22 H29 N3 O2 S |
| Smiles: | CC1(C)CC(=C(C(C1)=O)C(Nc1ccccc1)=S)NCCCN1CCCC1=O |
| Stereo: | ACHIRAL |
| logP: | 2.3346 |
| logD: | 2.3117 |
| logSw: | -2.8489 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.557 |
| InChI Key: | OOYGZVDHVLEOMJ-UHFFFAOYSA-N |